SCHEMBL25317059

SCHEMBL25317059

CC(C)Nc1ncc(-c2ccc3cc(O)ccc3n2)c(=O)n1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDGFRB P09619 3/20 0.47
▸ CSF1R P07333 2/20 0.47
▸ PDGFRA P16234 2/20 0.47
▸ LCK P06239 1/20 0.47
▸ KIT P10721 1/20 0.47
▸ CYP2C9 P11712 1/20 0.47
▸ FLT3 P36888 1/20 0.47
▸ PTK6 Q13882 1/20 0.47
▸ ESR1 P03372 1/20 0.40
▸ ESR2 Q92731 1/20 0.40
▸ BACE1 P56817 1/20 0.39
▸ TYR P14679 1/20 0.36
▸ FGFR1 P11362 2/20 0.35
▸ SYK P43405 9/20 0.33
▸ ABL1 P00519 1/20 0.32
▸ EGFR P00533 1/20 0.32
▸ SRC P12931 1/20 0.32
▸ MAPK14 Q16539 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PDE3B Q13370 1/20 0.32

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
SCHEMBL25317161 0.87 ESR1 (0.43) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL31010902 0.87 ESR1 (0.43) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25911557 0.87 PDGFRB (0.42) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25911644 0.85 CSF1R (0.47) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25317420 0.84 ESR1 (0.40) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25319475 0.84 CSF1R (0.47) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25911369 0.84 CSF1R (0.45) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25911603 0.83 CSF1R (0.48) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25914664 0.82 ESR1 (0.38) PDGFRBCSF1RPDGFRALCKKIT
SCHEMBL25913396 0.81 ESR2 (0.46) PDGFRBPDGFRAESR1ESR2BACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023125812-A1 SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF 上海海雁医药科技有限公司 2023-07-06 — — WO disclosed
WO-2023125812-A1 SUBSTITUTED PYRIMIDONE DERIVATIVE, AND PHARMACEUTICAL COMPOSITION AND MEDICAL USE THEREOF 上海海雁医药科技有限公司 2023-07-06 — — WO disclosed
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