SCHEMBL9720422

SCHEMBL9720422

Clc1ccc2ccccc2c1Br

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 5/20 0.60
POLB P06746 1/20 0.56
CYP1A2 P05177 5/20 0.52
ALDH1A1 P00352 4/20 0.50
HSD17B10 Q99714 3/20 0.50
TSHR P16473 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
HPRT1 P00492 1/20 0.46
PAX8 Q06710 1/20 0.43
HIF1A Q16665 1/20 0.42
CYP1B1 Q16678 1/20 0.42
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NCEH1 Q6PIU2 2/20 0.40
LMNA P02545 1/20 0.39
CYP3A4 P08684 1/20 0.39
APEX1 P27695 1/20 0.39
MAPK1 P28482 1/20 0.39
PMP22 Q01453 1/20 0.39
NPC1 O15118 1/20 0.38

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
SCHEMBL30845983 1.00 CYP2A6 (0.60) CYP2A6POLBCYP1A2ALDH1A1HSD17B10
SCHEMBL30274592 1.00 CYP2A6 (0.60) CYP2A6POLBCYP1A2ALDH1A1HSD17B10
SCHEMBL24316390 0.77 CYP2A6 (0.48) CYP2A6POLBCYP1A2ALDH1A1HSD17B10
SCHEMBL24048456 0.77 CYP2A6 (0.46) CYP2A6POLBCYP1A2ALDH1A1HSD17B10
SCHEMBL24047877 0.76 CYP2A6 (0.44) CYP2A6POLBCYP1A2ALDH1A1HSD17B10
SCHEMBL5673224 0.75 CYP2A6 (0.65) CYP2A6CYP1A2ALDH1A1HSD17B10TSHR
SCHEMBL449348 0.75 CYP2A6 (1.00) CYP2A6CYP1A2ALDH1A1HSD17B10TSHR
SCHEMBL1187756 0.75 POLB (0.60) CYP2A6POLBCYP1A2ALDH1A1HSD17B10
SCHEMBL24047527 0.73 CYP1A1 (0.43) CYP2A6CYP1A2ALDH1A1HSD17B10TSHR
Ammonia Solution, Strong SCHEMBL11476794 0.73 CYP2A6 (0.95) CYP2A6CYP1A2ALDH1A1HSD17B10TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12630566-B2 KRas G12D inhibitors Mirati Therapeutics, Inc. (US) 2026-05-19 US disclosed
US-20240309020-A1 KRAS G12D INHIBITORS ARRAY BIOPHARMA INC. 2024-09-19 US disclosed
US-11964989-B2 KRas G12D inhibitors Mirati Therapeutics, Inc. (US) 2024-04-23 US disclosed
CN-114615981-B KRAS G12D inhibitors 米拉蒂治疗股份有限公司 2024-04-12 CN disclosed
EP-3305792-B1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME LG CHEMICAL LTD (KR) 2024-04-10 EP disclosed
EP-3305792-B1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME LG CHEMICAL LTD (KR) 2024-04-10 EP disclosed
US-20230279025-A1 KRAS G12D INHIBITORS ARRAY BIOPHARMA INC. 2023-09-07 US disclosed
US-20230279025-A1 KRAS G12D INHIBITORS ARRAY BIOPHARMA INC. 2023-09-07 US disclosed
CN-116438946-A Organic light emitting device 株式会社LG化学 2023-07-14 CN disclosed
CN-116419921-A Compound and organic light emitting device comprising the same 株式会社LG化学 2023-07-11 CN disclosed
EP-3305792-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING ELEMENT USING SAME LG Chem, Ltd. (KR) 2018-04-11 EP disclosed
US-20170213984-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG CHEM, LTD. (KR) 2017-07-27 US disclosed
US-20170213984-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG CHEM, LTD. (KR) 2017-07-27 US disclosed
US-20170213984-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME LG CHEM, LTD. (KR) 2017-07-27 US disclosed
CN-106661037-A Nitrogen-containing fused ring compound and organic light-emitting device using same 株式会社LG化学 2017-05-10 CN disclosed
CN-103553866-B A kind of method preparing adjacent two/trihalogenated benzene ZHEJIANG NORMAL UNIVERSITY (CN) 2015-11-25 CN disclosed
CN-103553866-A Method for preparing o-dihalogeno/trihalogeno benzene UNIV ZHEJIANG NORMAL 2014-02-05 CN disclosed
US-5114896-A Reaction product of magnesium, halogenated hydrocarbon, alkoxy compound, titanium compound, halogen-containing alcohol and solid halogenated hydrocarbon TONEN CORPORATION (JP) 1992-05-19 US disclosed
EP-0440813-A1 METHOD OF PRODUCING CATALYST COMPONENT FOR OLEFIN POLYMERIZATION Tonen Corporation (JP) 1991-08-14 EP disclosed
US-3989746-A ANALGESICS, ANTIINFLAMMATORY AGENTS IKEDA MOHANDO CO., LTD. (JA) 1976-11-02 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 (5 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-20230279025-A1 KRAS G12D INHIBITORS KRAS, NRAS, HRAS CYP2A6 3249/4885POLB 1346/4885CYP1A2 4527/4885
US-12630566-B2 KRas G12D inhibitors KRAS, NRAS, HRAS CYP2A6 3178/4885POLB 2333/4885CYP1A2 4159/4885
US-11964989-B2 KRas G12D inhibitors KRAS, NRAS, HRAS CYP2A6 3961/4885POLB 1356/4885CYP1A2 4709/4885
US-20170213984-A1 NITROGEN-CONTAINING CONDENSED CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME CRY1, NOS1, NOLC1 CYP2A6 1800/4885POLB 1068/4885CYP1A2 667/4885
US-20240309020-A1 KRAS G12D INHIBITORS KRAS, NRAS, HRAS CYP2A6 3105/4885POLB 1319/4885CYP1A2 4446/4885

“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.