SCHEMBL191276

SCHEMBL191276

Brc1cccc(-c2cccc(-c3cccc(Br)c3)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
GABRG2 P18507 4/20 0.50
GABRB3 P28472 4/20 0.50
GABRA5 P31644 4/20 0.50
GABRA3 P34903 4/20 0.50
RAB9A P51151 4/20 0.50
GABRA1 P14867 3/20 0.50
NPC1 O15118 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
BIRC5 O15392 1/20 0.50
MAPK1 P28482 1/20 0.50
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
IDO1 P14902 2/20 0.48
METAP2 P50579 1/20 0.48
CYP1A2 P05177 1/20 0.48
HPGD P15428 2/20 0.47
MAPT P10636 2/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15624388 1.00 ALDH1A1 (0.50) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL29398919 1.00 ALDH1A1 (0.50) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL29696912 0.97 GABRG2 (0.48) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL16675046 0.97 GABRG2 (0.48) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL1345303 0.97 GABRG2 (0.48) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL16675055 0.97 GABRG2 (0.48) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL312091 0.97 ALDH1A1 (0.52) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL29546450 0.97 ALDH1A1 (0.52) ALDH1A1GABRG2GABRB3GABRA5GABRA3
SCHEMBL26301211 0.94 ALDH1A1 (0.50) ALDH1A1GABRG2GABRB3GABRA5GABRA3
Water SCHEMBL28248751 0.94 ALDH1A1 (0.50) ALDH1A1GABRG2GABRB3GABRA5GABRA3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 65 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022255428-A1 AROMATIC COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT, COMPOSITION, AND METHOD FOR PRODUCING ORGANIC ELECTROLUMINESCENT ELEMENT 三菱ケミカル株式会社 2022-12-08 WO disclosed
US-11205755-B2 Compound for organic electronic element, organic electronic element using same, and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2021-12-21 US disclosed
EP-3220437-B1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2021-04-14 EP disclosed
EP-3218368-B1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2020-11-25 EP disclosed
EP-3244462-B1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2020-11-11 EP disclosed
US-10693078-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2020-06-23 US disclosed
US-10651389-B2 Materials for electronic devices MERCK PATENT GMBH (DE) 2020-05-12 US disclosed
EP-3017016-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-04-15 EP disclosed
EP-3017016-B1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2020-04-15 EP disclosed
US-10593884-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2020-03-17 US disclosed
US-20110108814-A1 POLYMER COMPOUND, NET-LIKE POLYMER COMPOUND PRODUCED BY CROSSLINKING THE POLYMER COMPOUND, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2011-05-12 US disclosed
US-20110108814-A1 POLYMER COMPOUND, NET-LIKE POLYMER COMPOUND PRODUCED BY CROSSLINKING THE POLYMER COMPOUND, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2011-05-12 US disclosed
US-20110042661-A1 CONJUGATED POLYMER, INSOLUBILIZED POLYMER, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, POLYMER PRODUCTION PROCESS, ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC EL DISPLAY AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2011-02-24 US disclosed
US-20110042661-A1 CONJUGATED POLYMER, INSOLUBILIZED POLYMER, ORGANIC ELECTROLUMINESCENCE ELEMENT MATERIAL, COMPOSITION FOR ORGANIC ELECTROLUMINESCENCE ELEMENT, POLYMER PRODUCTION PROCESS, ORGANIC ELECTROLUMINESCENCE ELEMENT, ORGANIC EL DISPLAY AND ORGANIC EL LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2011-02-24 US disclosed
US-20110024735-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2011-02-03 US disclosed
US-20110024735-A1 COMPOUND FOR ORGANIC ELECTROLUMINESCENT DEVICE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2011-02-03 US disclosed
EP-2272894-A1 POLYMER COMPOUND, RETICULATED POLYMER COMPOUND PRODUCED BY CROSSLINKING THE POLYMER COMPOUND, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC EL DISPLAY, AND ORGANIC EL LIGHTING Mitsubishi Chemical Corporation (JP) 2011-01-12 EP disclosed
EP-2270069-A1 CONJUGATED POLYMER, INSOLUBILIZED POLYMER, ORGANIC ELECTROLUMINESCENT DEVICE MATERIAL, COMPOSITION FOR ORGANIC ELECTROLUMINESCENT DEVICE, METHOD FOR PRODUCING POLYMER, ORGANIC ELECTROLUMINESCENT DEVICE, ORGANIC EL DISPLAY, AND ORGANIC EL ILLUMINATOR Mitsubishi Chemical Corporation (JP) 2011-01-05 EP disclosed
EP-1847521-A1 BISANTHRACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-10-24 EP disclosed
US-20060216633-A1 Bisanthracene derivative and organic electroluminescence device using the same IDEMITSU KOSAN CO., LTD. (JP) 2006-09-28 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10651389-B2 Materials for electronic devices EFNA1, NES, EED ALDH1A1 127/4885GABRG2 2079/4885GABRB3 2780/4885
US-10593884-B2 Organic electroluminescent device AHR, SLC18A1, KCNH1 ALDH1A1 228/4885GABRG2 4162/4885GABRB3 3773/4885
US-10693078-B2 Organic electroluminescent device KCNN2, SLC7A5, KCNH3 ALDH1A1 579/4885GABRG2 3837/4885GABRB3 3535/4885
US-11205755-B2 Compound for organic electronic element, organic electronic element using same, and electronic device thereof PIEZO1, OR51E2, ORAI2 ALDH1A1 2676/4885GABRG2 3264/4885GABRB3 4325/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.