SCHEMBL25913006

SCHEMBL25913006

COc1nc(NC(C)C)ncc1-c1ccc2cc(Oc3ccnc(NC(=O)OC(C)(C)C)c3)ccc2n1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CSF1R P07333 2/20 0.40
▸ PDGFRA P16234 2/20 0.40
▸ PDGFRB P09619 1/20 0.40
▸ RIOK2 Q9BVS4 4/20 0.39
▸ P2RX3 P56373 1/20 0.37
▸ KDM4E B2RXH2 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ IRAK4 Q9NWZ3 1/20 0.36
▸ BRAF P15056 7/20 0.36
▸ AAK1 Q2M2I8 2/20 0.35
▸ GSK3A P49840 2/20 0.34
▸ MAPK10 P53779 2/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33

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
SCHEMBL25913590 0.93 CSF1R (0.43) CSF1RPDGFRAPDGFRBRIOK2BRAF
SCHEMBL25912909 0.90 PDGFRB (0.50) CSF1RPDGFRAPDGFRBRIOK2BRAF
SCHEMBL25912757 0.88 P2RX3 (0.36) RIOK2P2RX3IRAK4BRAF
SCHEMBL25913001 0.81 BRAF (0.35) CSF1RPDGFRAPDGFRBIRAK4BRAF
SCHEMBL25912707 0.78 P2RX3 (0.40) CSF1RPDGFRAPDGFRBRIOK2P2RX3
SCHEMBL25910551 0.76 CSF1R (0.49) CSF1RPDGFRAPDGFRBRIOK2P2RX3
SCHEMBL25910690 0.76 CSF1R (0.64) CSF1RPDGFRAPDGFRBRIOK2BRAF
SCHEMBL16049203 0.76 CSF1R (0.68) CSF1RPDGFRAPDGFRBRIOK2BRAF
SCHEMBL25911299 0.75 CSF1R (0.52) CSF1RPDGFRAPDGFRB
SCHEMBL25913221 0.74 P2RX3 (0.38) CSF1RPDGFRAPDGFRBP2RX3KDM4E

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
Send feedback