SCHEMBL25912094

SCHEMBL25912094

CC(C)Nc1ncc(-c2ccc3c(Br)c(O)ccc3n2)c(=O)n1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 2/20 0.43
▸ PDGFRB P09619 2/20 0.43
▸ LCK P06239 1/20 0.43
▸ KIT P10721 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ PDGFRA P16234 1/20 0.43
▸ FLT3 P36888 1/20 0.43
▸ PTK6 Q13882 1/20 0.43
▸ ESR1 P03372 1/20 0.42
▸ ESR2 Q92731 1/20 0.42
▸ BACE1 P56817 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ FGFR1 P11362 1/20 0.31
▸ ADRB2 P07550 1/20 0.31
▸ ADRB1 P08588 1/20 0.31
▸ HTR1A P08908 1/20 0.31
▸ CSNK2A2 P19784 1/20 0.31

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
SCHEMBL30825676 0.81 CSF1R (0.54) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL29222872 0.81 CSF1R (0.54) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25912095 0.81 LCK (0.42) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25317059 0.80 PDGFRB (0.47) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25911644 0.78 CSF1R (0.47) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25911715 0.78 CSF1R (0.43) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25911369 0.77 CSF1R (0.45) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL21872971 0.76 CSF1R (0.53) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25911557 0.75 PDGFRB (0.42) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25319475 0.73 CSF1R (0.47) CSF1RPDGFRBLCKKITCYP2C9

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 1 patent. 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
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