SCHEMBL29937247

SCHEMBL29937247

Cc1cc2[nH]ncc2c(Br)c1C(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 12/20 0.45
CYP1A2 P05177 8/20 0.45
PTPN6 P29350 1/20 0.41
IDO1 P14902 2/20 0.41
TDO2 P48775 2/20 0.41
AXL P30530 2/20 0.40
TRPA1 O75762 1/20 0.38
TRPM8 Q7Z2W7 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
CDK2 P24941 1/20 0.38
CCNA1 P78396 1/20 0.38
NOS1 P29475 1/20 0.36

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
SCHEMBL20974448 1.00 METAP2 (0.45) METAP2CYP1A2PTPN6IDO1TDO2
SCHEMBL23206123 0.83 METAP2 (0.47) METAP2CYP1A2PTPN6IDO1TDO2
SCHEMBL21196238 0.78 IDO1 (0.48) METAP2CYP1A2PTPN6IDO1TDO2
SCHEMBL29344861 0.78 METAP2 (0.43) METAP2CYP1A2IDO1TDO2AXL
SCHEMBL24971018 0.78 METAP2 (0.43) METAP2CYP1A2PTPN6IDO1AXL
SCHEMBL19948646 0.77 IDO1 (0.47) METAP2CYP1A2PTPN6IDO1TDO2
SCHEMBL30410207 0.77 IDO1 (0.47) METAP2CYP1A2PTPN6IDO1TDO2
SCHEMBL29344213 0.76 METAP2 (0.44) METAP2CYP1A2PTPN6IDO1TDO2
SCHEMBL29344562 0.75 TRPA1 (0.45) METAP2CYP1A2AXLTRPA1TRPM8
SCHEMBL29344290 0.74 METAP2 (0.38) METAP2CYP1A2PTPN6IDO1TDO2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4713330-A1 TRICYCLIC COMPOUNDS AND USES THEREOF HUTCHMED Limited (CN) 2026-03-25 EP disclosed
EP-4709371-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT Merck Sharp & Dohme LLC (US) 2026-03-18 EP disclosed
EP-4709729-A1 PYRAZOLO[4,3-F]QUINAZOLINE DERIVATIVES AS MODULATORS OF G12D MUTANT KRAS USEFUL FOR THE TREATMENT OF CANCER Jazz Pharmaceuticals Ireland Ltd. (IE) 2026-03-18 EP disclosed
WO-2025217319-A1 RAS INHIBITORS AND METHODS OF USE THEREOF KESTREL THERAPEUTICS INC. (US) 2025-10-16 WO disclosed
EP-4615847-A1 SMALL MOLECULE INHIBITORS OF KRAS PROTEINS Merck Sharp & Dohme LLC (US) 2025-09-17 EP disclosed
EP-4501932-A2 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2025-02-05 EP disclosed
WO-2024236452-A1 PYRAZOLO[4,3-F]QUINAZOLINE DERIVATIVES AS MODULATORS OF G12D MUTANT KRAS USEFUL FOR THE TREATMENT OF CANCER JAZZ PHARMACEUTICALS IRELAND LTD. (IE) 2024-11-21 WO disclosed
WO-2024235286-A1 TRICYCLIC COMPOUNDS AND USES THEREOF HUTCHMED LIMITED (CN) 2024-11-21 WO disclosed
EP-3880208-B1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2024-11-20 EP disclosed
WO-2024233776-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT MERCK SHARP & DOHME LLC (US) 2024-11-14 WO disclosed
CN-118302162-A Small molecule inhibitors of KRAS muteins 默沙东有限责任公司 2024-07-05 CN disclosed
WO-2024123102-A1 NOVEL TRICYCLIC COMPOUND AS KRAS G12D INHIBITOR, AND USE THEREOF 에스케이바이오팜 주식회사 2024-06-13 WO disclosed
WO-2024103010-A1 SMALL MOLECULE INHIBITORS OF KRAS PROTEINS MERCK SHARP & DOHME LLC (US) 2024-05-16 WO disclosed
EP-4347041-A1 SMALL MOLECULE INHIBITORS OF KRAS MUTATED PROTEINS Taiho Pharmaceutical Co., Ltd. (JP) 2024-04-10 EP disclosed
CN-117769554-A Small molecule inhibitors of KRAS muteins 大鹏药品工业株式会社 2024-03-26 CN disclosed
EP-4322954-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT Merck Sharp & Dohme LLC (US) 2024-02-21 EP disclosed
EP-3710439-B1 KRAS G12C INHIBITORS MIRATI THERAPEUTICS INC (US) 2023-02-15 EP disclosed
WO-2022250170-A9 SMALL MOLECULE INHIBITORS OF KRAS MUTATED PROTEINS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2023-01-05 WO disclosed
WO-2022250170-A1 SMALL MOLECULE INHIBITORS OF KRAS MUTATED PROTEINS TAIHO PHARMACEUTICAL CO., LTD. (JP) 2022-12-01 WO disclosed
WO-2022221739-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT MERCK SHARP & DOHME CORP. (US) 2022-10-20 WO disclosed