SCHEMBL25912060

SCHEMBL25912060

CC(C)Nc1ncc(-c2ccc3cc(Oc4ccnc([N+](=O)[O-])c4)ccc3n2)c(=O)n1C

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 6/20 0.51
▸ PDGFRA P16234 4/20 0.51
▸ PDGFRB P09619 3/20 0.51
▸ LCK P06239 2/20 0.51
▸ KIT P10721 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ FLT3 P36888 1/20 0.51
▸ PTK6 Q13882 1/20 0.51
▸ KDR P35968 2/20 0.36
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC8 Q9BY41 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ SCN9A Q15858 3/20 0.32
▸ FGFR1 P11362 1/20 0.31
▸ BRAF P15056 3/20 0.31
▸ SMN1; SMN2 Q16637 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
SCHEMBL25911790 0.86 CSF1R (0.53) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25910028 0.86 CSF1R (0.53) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25913293 0.86 CSF1R (0.52) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25910302 0.85 CSF1R (0.51) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25910568 0.84 CSF1R (0.55) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25910026 0.83 CSF1R (0.50) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25910683 0.83 CSF1R (0.56) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25911894 0.83 CSF1R (0.51) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25909917 0.83 PDGFRB (0.52) CSF1RPDGFRAPDGFRBLCKKIT
SCHEMBL25909911 0.83 CSF1R (0.55) CSF1RPDGFRAPDGFRBLCKKIT

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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