SCHEMBL29625547

SCHEMBL29625547

CC(C)n1cc(C(N)=O)c(=O)n(-c2ccccc2F)c1=O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 1/20 0.43
▸ MERTK Q12866 2/20 0.38
▸ NOTUM Q6P988 1/20 0.38
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MET P08581 3/20 0.36
▸ BTK Q06187 1/20 0.35
▸ AXL P30530 3/20 0.35
▸ PARP1 P09874 1/20 0.35
▸ PARP2 Q9UGN5 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ TYRO3 Q06418 1/20 0.35
▸ RPS6KB1 P23443 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
SCHEMBL29814279 0.88 NOTUM (0.48) KMT2AMERTKNOTUMSMN1; SMN2MET
SCHEMBL23071294 0.88 NOTUM (0.48) KMT2AMERTKNOTUMSMN1; SMN2MET
SCHEMBL30031445 0.87 ALDH1A1 (0.41) KMT2AMERTKNOTUMMETAXL
SCHEMBL23749566 0.87 ALDH1A1 (0.41) KMT2AMERTKNOTUMMETAXL
SCHEMBL30672106 0.86 MERTK (0.43) KMT2AMERTKTSHRMETAXL
SCHEMBL29625543 0.82 KMT2A (0.48) KMT2AMERTKIRAK4METAXL
Hydrochloric Acid SCHEMBL31614377 0.81 KMT2A (0.47) KMT2AMERTKIRAK4METAXL
SCHEMBL29536487 0.80 AXL (0.47) MERTKMETAXLTYRO3
Hydrochloric Acid SCHEMBL30297740 0.79 AXL (0.47) MERTKMETAXLTYRO3
SCHEMBL31016258 0.79 MAP2K2 (0.41) KMT2ANOTUMTSHRSMN1; SMN2MET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114456175-B Pyrrolotriazine compounds as TAM inhibitors 因赛特公司 2024-09-03 — — CN claimed
EP-3436461-B1 PYRROLOTRIAZINE COMPOUNDS AS TAM INHIBITORS INCYTE CORP (US) 2023-11-01 — — EP claimed
CN-114456176-A Pyrrolotriazine compounds as TAM inhibitors 因赛特公司 2022-05-10 — — CN claimed
CN-114456175-B Pyrrolotriazine compounds as TAM inhibitors 因赛特公司 2024-09-03 — — CN disclosed
CN-114456176-B Pyrrolotriazine compounds as TAM inhibitors 因赛特公司 2024-08-30 — — CN disclosed
CN-116283916-B Compound with Axl and c-Met kinase inhibition activity and preparation and application thereof 中国科学院上海药物研究所 2024-06-11 — — CN disclosed
CN-116283916-A Compound with Axl and c-Met kinase inhibition activity and preparation and application thereof 中国科学院上海药物研究所 2023-06-23 — — CN disclosed
CN-111196814-B Aromatic ring-linked dioxane quinazoline or quinoline compound, composition and application thereof 北京赛特明强医药科技有限公司 2022-12-06 — — CN disclosed
CN-112457295-B Compound with Axl and c-Met kinase inhibitory activity and preparation and application thereof 中国科学院上海药物研究所 2022-07-26 — — CN disclosed
CN-114456175-A Pyrrolotriazine compounds as TAM inhibitors 因赛特公司 2022-05-10 — — CN disclosed
CN-114456176-A Pyrrolotriazine compounds as TAM inhibitors 因赛特公司 2022-05-10 — — CN disclosed
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