SCHEMBL2163690

SCHEMBL2163690

Brc1cc(I)cc(-c2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
MAPK1 P28482 2/20 0.48
CRHBP P24387 1/20 0.45
CRHR2 Q13324 1/20 0.45
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
SMN1; SMN2 Q16637 3/20 0.37
TSHR P16473 2/20 0.37
TP53 P04637 1/20 0.37
IDO1 P14902 1/20 0.37
AKR1C3 P42330 2/20 0.36
AKR1C2 P52895 2/20 0.36
AKR1C1 Q04828 2/20 0.36
AKR1C4 P17516 1/20 0.36
NFKB1 P19838 1/20 0.35
NFKB2 Q00653 1/20 0.35
RELA Q04206 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
SCHEMBL29877142 1.00 ALDH1A1 (0.48) ALDH1A1MAPK1CRHBPCRHR2SLC6A2
SCHEMBL45718 0.83 ALDH1A1 (0.60) ALDH1A1MAPK1CRHBPCRHR2SLC6A2
SCHEMBL16901964 0.83 ALDH1A1 (0.53) ALDH1A1MAPK1CRHBPCRHR2SLC6A4
SCHEMBL21892151 0.83 ALDH1A1 (0.53) ALDH1A1MAPK1CRHBPCRHR2SLC6A4
SCHEMBL1562747 0.83 ALDH1A1 (0.60) ALDH1A1MAPK1CRHBPCRHR2SLC6A2
SCHEMBL2194491 0.83 ALDH1A1 (0.53) ALDH1A1MAPK1CRHBPCRHR2SLC6A4
SCHEMBL15358382 0.80 ALDH1A1 (0.65) ALDH1A1MAPK1CRHBPCRHR2SLC6A2
Phosphine SCHEMBL28191580 0.80 ALDH1A1 (0.50) ALDH1A1MAPK1CRHBPCRHR2SLC6A4
SCHEMBL12996631 0.80 ALDH1A1 (0.57) ALDH1A1MAPK1CRHBPCRHR2SLC6A2
SCHEMBL18552200 0.80 ALDH1A1 (0.65) ALDH1A1MAPK1CRHBPCRHR2SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250280727-A1 Organic Compound And Organic Light-Emitting Diode Including Same P&H TECH CO., LTD (KR) 2025-09-04 US disclosed
US-12018037-B2 Organometallic compound, organic light-emitting device including the organometallic compound, and diagnostic composition including the organometallic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-06-25 US disclosed
US-12018037-B2 Organometallic compound, organic light-emitting device including the organometallic compound, and diagnostic composition including the organometallic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-06-25 US disclosed
US-12022732-B2 Materials for organic electroluminescent devices MERCK PATENT GMBH (DE) 2024-06-25 US disclosed
US-12018037-B2 Organometallic compound, organic light-emitting device including the organometallic compound, and diagnostic composition including the organometallic compound SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-06-25 US disclosed
US-11910709-B2 Organic compound, and electronic element and electronic device using same SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2024-02-20 US disclosed
CN-110563767-B Organometallic compound, organic light emitting device and diagnostic composition including the same 三星电子株式会社 2024-01-05 CN disclosed
WO-2023214788-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING SAME (주)피엔에이치테크 2023-11-09 WO disclosed
WO-2023204529-A1 ORGANIC COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME (주)피엔에이치테크 2023-10-26 WO disclosed
US-20230301182-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-09-21 US disclosed
US-7985491-B2 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same IDEMITSU KOSAN CO., LTD. (JP) 2011-07-26 US disclosed
EP-1864962-A1 ANTHRYLARYLENE DERIVATIVE, MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE, AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-12-12 EP disclosed
US-20070088185-A1 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same IDEMITSU KOSAN CO., LTD. (JP) 2007-04-19 US disclosed
US-5350846-A Antibiotics MERCK & CO., INC. (US) 1994-09-27 US disclosed
US-5208329-A Antibacterial agents MERCK & CO., INC. (US) 1993-05-04 US disclosed
US-5182385-A Chemical intermediates for bactericides MERCK & CO., INC. (US) 1993-01-26 US disclosed
EP-0467434-A1 2-Biphenyl-carbapenem antibacterial agents MERCK & CO. INC. (US) 1992-01-22 EP disclosed
EP-0464900-A2 2-Biphenyl-carbapenems MERCK & CO. INC. (US) 1992-01-08 EP disclosed
US-5025006-A Carbapenicillin antibiotics MERCK & CO., INC. (US) 1991-06-18 US disclosed
US-5011832-A 2-biphenyl-carbapenem antibacterial agents MERCK & CO., INC. (US) 1991-04-30 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 (6 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-11910709-B2 Organic compound, and electronic element and electronic device using same OR10J3, ESR1, EPCAM ALDH1A1 496/4885MAPK1 1732/4885CRHBP 4727/4885
US-20250280727-A1 Organic Compound And Organic Light-Emitting Diode Including Same MAP1LC3B, VDAC1, SLC7A5 ALDH1A1 2144/4885MAPK1 2886/4885CRHBP 4575/4885
US-20230301182-A1 ORGANIC COMPOUND, AND ELECTRONIC ELEMENT AND ELECTRONIC DEVICE USING SAME OR10J3, ESR1, EPCAM ALDH1A1 496/4885MAPK1 1732/4885CRHBP 4727/4885
US-12022732-B2 Materials for organic electroluminescent devices MT-CO3, MT-ND3, MT-ND5 ALDH1A1 1315/4885MAPK1 3219/4885CRHBP 4048/4885
US-20070088185-A1 Anthrylarylene derivative, material for organic electroluminescence device and organic electroluminescence device using same RABGGTA, ALAD, GCDH ALDH1A1 139/4885MAPK1 3575/4885CRHBP 4838/4885
US-12018037-B2 Organometallic compound, organic light-emitting device including the organometallic compound, and diagnostic composition including the organometallic compound ORC3, LEF1, OCIAD1 ALDH1A1 147/4885MAPK1 3152/4885CRHBP 4172/4885

“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.