SCHEMBL30183986

SCHEMBL30183986

CP(C)(=O)c1cc(O)ccc1Oc1nc(Cl)ncc1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ALDH1A1 P00352 2/20 0.36
▸ GAA P10253 1/20 0.36
▸ PIN1 Q13526 10/20 0.34
▸ MAPK1 P28482 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ INSR P06213 2/20 0.32
▸ IGF1R P08069 2/20 0.32
▸ ALK Q9UM73 2/20 0.32
▸ KDR P35968 2/20 0.31
▸ RET P07949 1/20 0.31
▸ KIF5B P33176 1/20 0.31
▸ ESRRB O95718 1/20 0.31
▸ ESR1 P03372 1/20 0.31
▸ ESRRA P11474 1/20 0.31
▸ ESR2 Q92731 1/20 0.31
▸ EGFR P00533 1/20 0.30

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
SCHEMBL29172306 1.00 KDM4E (0.37) KDM4EMEN1MAPTKMT2AALDH1A1
SCHEMBL18812797 0.81 PIN1 (0.44) ALDH1A1PIN1INSRIGF1RALK
SCHEMBL30875696 0.81 PIN1 (0.44) ALDH1A1PIN1INSRIGF1RALK
SCHEMBL25947639 0.80 ALDH1A1 (0.38) KDM4EMEN1MAPTKMT2AALDH1A1
SCHEMBL29172293 0.79 PIN1 (0.43) MEN1KMT2AALDH1A1PIN1SMN1; SMN2
SCHEMBL30875700 0.79 PIN1 (0.43) MEN1KMT2AALDH1A1PIN1SMN1; SMN2
Phosphine SCHEMBL25950919 0.75 KDM4E (0.35) KDM4EMEN1MAPTKMT2AALDH1A1
SCHEMBL23933001 0.73 INSR (0.47) INSRIGF1RALKEGFR
SCHEMBL30776709 0.67 MEN1 (0.41) KDM4EMEN1MAPTKMT2AALDH1A1
SCHEMBL19103241 0.67 ALDH1A1 (0.39) KDM4EALDH1A1GAAPIN1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4367123-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS Glenmark Specialty S.A. (CH) 2024-05-15 — — EP disclosed
CN-117730083-A Pyrimidine compounds as MAP4K1 inhibitors 格兰马克专业公司 2024-03-19 — — CN disclosed
WO-2023281417-A1 PYRIMIDINE COMPOUNDS FOR USE AS MAP4K1 INHIBITORS GLENMARK SPECIALTY S.A. (CH) 2023-01-12 — — WO disclosed
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