SCHEMBL1003086

SCHEMBL1003086

Cc1ccc(N)c(Br)c1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 8/20 0.44
ALDH1A1 P00352 6/20 0.44
TDP1 Q9NUW8 5/20 0.44
TSHR P16473 4/20 0.44
POLB P06746 1/20 0.39
CASP1 P29466 1/20 0.39
MAPK1 P28482 1/20 0.38
PIK3CA P42336 1/20 0.38
NCEH1 Q6PIU2 1/20 0.37
ALOX15 P16050 2/20 0.36
CYP1A2 P05177 1/20 0.36
CASP7 P55210 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD17B10 Q99714 1/20 0.36
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
TP53 P04637 1/20 0.35
THRB P10828 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
S100B P04271 1/20 0.34

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
SCHEMBL31398189 0.86 CYP3A4 (0.43) CYP3A4ALDH1A1TDP1TSHRPOLB
SCHEMBL27982658 0.83 CYP3A4 (0.48) CYP3A4ALDH1A1TDP1TSHRPOLB
SCHEMBL10798531 0.81 CYP3A4 (0.46) CYP3A4ALDH1A1TDP1TSHRPOLB
SCHEMBL1198813 0.79 ALDH1A1 (0.44) CYP3A4ALDH1A1TDP1TSHRPOLB
SCHEMBL29566675 0.79 ALDH1A1 (0.44) CYP3A4ALDH1A1TDP1TSHRPOLB
SCHEMBL2319989 0.79 ALDH1A1 (0.39) CYP3A4ALDH1A1TDP1TSHRPOLB
SCHEMBL10753626 0.77 NCEH1 (0.42) ALDH1A1TSHRPOLBNCEH1CYP1A2
SCHEMBL28457584 0.77 CYP3A4 (0.38) CYP3A4ALDH1A1TDP1TSHRPOLB
SCHEMBL31152966 0.75 CYP3A4 (0.36) CYP3A4ALDH1A1TDP1TSHRPIK3CA
SCHEMBL10989519 0.75 ALDH1A1 (0.48) CYP3A4ALDH1A1TDP1TSHRMAPK1

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 51 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-20250388606-A1 AZAQUINAZOLINE PAN-KRAS INHIBITORS MIRATI THERAPEUTICS INC (US) 2025-12-25 US disclosed
US-12398154-B2 Azaquinazoline pan-KRas inhibitors Mirati Therapeutics, Inc. (US) 2025-08-26 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
CN-111683955-B Compound and organic light-emitting element comprising same 株式会社LG化学 2023-12-08 CN disclosed
EP-4262807-A1 AZAQUINAZOLINE PAN-KRAS INHIBITORS Mirati Therapeutics, Inc. (US) 2023-10-25 EP disclosed
CN-116813610-A Selenophene-containing cycloindole sulfonate inner salt and preparation method and application thereof 德州学院 2023-09-29 CN disclosed
CN-116829151-A Azaquinazoline pan KRAS inhibitors 米拉蒂治疗股份有限公司 2023-09-29 CN disclosed
US-6960640-B2 Composition for optical material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2005-11-01 US disclosed
US-20040147708-A1 Composition for optical material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-07-29 US disclosed
EP-1426392-A1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-06-09 EP disclosed
WO-1992019622-A1 ARYLLITHIUM PROCESS FMC CORPORATION (US) 1992-11-12 WO disclosed
US-5099044-A ORGANOMETALLIC COMPOUNDS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1992-03-24 US disclosed
EP-0399021-A1 ORGANOALUMINIUM, ORGANOGALLIUM AND ORGANOINDIUM COMPOUNDS AND THEIR USE FOR THE GAS-PHASE DEPOSITION OF METAL ON SUBSTRATES MERCK PATENT GmbH (DE) 1990-11-28 EP disclosed
WO-1990006315-A1 ORGANOALUMINIUM, ORGANOGALLIUM AND ORGANOINDIUM COMPOUNDS AND THEIR USE FOR THE GAS-PHASE DEPOSITION OF METAL ON SUBSTRATES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1990-06-14 WO disclosed
US-4847438-A INSECTICIDES NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1989-07-11 US disclosed
EP-0321010-A1 New 11-arylsteroid compounds AKZO N.V. (NL) 1989-06-21 EP disclosed
US-4668701-A Pesticides NATIONAL RESEARCH DEVELOPMENT CORPORATION (GB) 1987-05-26 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-12630566-B2 KRas G12D inhibitors KRAS, NRAS, HRAS CYP3A4 4044/4885ALDH1A1 1816/4885TDP1 3446/4885
US-11964989-B2 KRas G12D inhibitors KRAS, NRAS, HRAS CYP3A4 4280/4885ALDH1A1 1957/4885TDP1 2880/4885
US-12398154-B2 Azaquinazoline pan-KRas inhibitors KRAS, NRAS, HRAS CYP3A4 3117/4885ALDH1A1 4127/4885TDP1 2579/4885
US-20250388606-A1 AZAQUINAZOLINE PAN-KRAS INHIBITORS KRAS, NRAS, HRAS CYP3A4 2558/4885ALDH1A1 3580/4885TDP1 3669/4885
US-20240309020-A1 KRAS G12D INHIBITORS KRAS, NRAS, HRAS CYP3A4 3974/4885ALDH1A1 2681/4885TDP1 2944/4885

“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.