SCHEMBL4137800

SCHEMBL4137800

Brc1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.52
MAPK1 P28482 3/20 0.52
MAPT P10636 3/20 0.39
HTT P42858 2/20 0.39
LMNA P02545 1/20 0.39
BACE1 P56817 1/20 0.37
ALOX5 P09917 1/20 0.37
CRHBP P24387 1/20 0.37
CRHR2 Q13324 1/20 0.37
FABP4 P15090 1/20 0.36
HSD17B10 Q99714 2/20 0.36
ANPEP P15144 2/20 0.36
HPGD P15428 1/20 0.36
BCL2L1 Q07817 1/20 0.36
IL1RN P18510 1/20 0.36
ERAP2 Q6P179 1/20 0.36
ERAP1 Q9NZ08 1/20 0.36
CYP2A6 P11509 1/20 0.36
HDAC4 P56524 1/20 0.35
HDAC2 Q92769 1/20 0.35

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
SCHEMBL30866153 1.00 ALDH1A1 (0.52) ALDH1A1MAPK1MAPTHTTLMNA
SCHEMBL4363398 0.92 ALDH1A1 (0.54) ALDH1A1MAPK1MAPTHTTLMNA
SCHEMBL27012160 0.88 CYP1A2 (0.50) ALDH1A1MAPK1HTTLMNAHSD17B10
SCHEMBL13319607 0.87 ALDH1A1 (0.50) ALDH1A1MAPK1MAPTHTTLMNA
SCHEMBL608536 0.84 ALDH1A1 (0.50) ALDH1A1MAPK1MAPTHTTLMNA
SCHEMBL66940 0.84 ALDH1A1 (0.50) ALDH1A1MAPK1MAPTHTTLMNA
SCHEMBL28575444 0.82 CRHBP (0.48) ALDH1A1MAPK1MAPTHTTLMNA
Biphenyl SCHEMBL28876393 0.82 ALDH1A1 (0.56) ALDH1A1MAPK1MAPTHTTLMNA
Water SCHEMBL28835132 0.82 LMNA (0.48) ALDH1A1MAPK1MAPTHTTLMNA
SCHEMBL28710407 0.82 LMNA (0.48) ALDH1A1MAPK1MAPTHTTLMNA

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117843500-A Aromatic amine compound and organic electroluminescent device comprising same 石家庄诚志永华显示材料有限公司 2024-04-09 CN disclosed
EP-2665342-B1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND ILLUMINATOR MITSUBISHI CHEM CORP (JP) 2021-03-03 EP disclosed
US-20180123054-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY AND LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2018-05-03 US disclosed
US-9899606-B2 Composition for organic electroluminescent element, organic electroluminescent element, display and lighting MITSUBISHI CHEMICAL CORPORATION (JP) 2018-02-20 US disclosed
US-20160043325-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY AND LIGHTING MITSUBISHI CHEMICAL CORPORATION (JP) 2016-02-11 US disclosed
EP-2665342-A1 COMPOSITION FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, DISPLAY DEVICE, AND ILLUMINATOR Mitsubishi Chemical Corporation (JP) 2013-11-20 EP disclosed
CN-102174154-A Binder resin and ink composition for roll printing comprising the same LG CHEMICAL LTD 2011-09-07 CN disclosed
US-20090005557-A1 Electron-Conjugated Organic Silane Compound and Production Method Thereof SHARP KABUSHIKI KAISHA (JP) 2009-01-01 US disclosed
US-20070116982-A1 Host material for organic electroluminescent element and organic electroluminescent element IDEMITSU KOSAN CO., LTD. (JP) 2007-05-24 US disclosed
EP-1708547-A1 HOST MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD. (JP) 2006-10-04 EP 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 (1 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-20090005557-A1 Electron-Conjugated Organic Silane Compound and Production Method Thereof MLX, RNF31, RPS4X ALDH1A1 2467/4885MAPK1 2429/4885MAPT 4190/4885

“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.