SCHEMBL25914529

SCHEMBL25914529

COc1ccc(CNc2ncc(-c3ccc4cc(Oc5ccnc(Br)c5)ccc4n3)c(=O)n2C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 4/20 0.41
▸ MAPT P10636 6/20 0.40
▸ THRB P10828 2/20 0.40
▸ CYP3A4 P08684 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ TSHR P16473 3/20 0.39
▸ KDR P35968 1/20 0.38
▸ CSF1R P07333 2/20 0.38
▸ PDGFRB P09619 2/20 0.38
▸ LCK P06239 1/20 0.38
▸ KIT P10721 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ PDGFRA P16234 1/20 0.38
▸ FLT3 P36888 1/20 0.38
▸ PTK6 Q13882 1/20 0.38
▸ TP53 P04637 4/20 0.36
▸ POLB P06746 2/20 0.36
▸ ALDH1A1 P00352 4/20 0.36
▸ LMNA P02545 1/20 0.36

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
SCHEMBL25914665 0.86 CSF1R (0.39) MAPTCYP3A4KDRCSF1RPDGFRB
SCHEMBL25911790 0.84 CSF1R (0.53) KDRCSF1RPDGFRBLCKKIT
SCHEMBL25914528 0.84 GAA (0.45) GAAMAPTTHRBCYP3A4MEN1
SCHEMBL25912706 0.83 CSF1R (0.43) MAPTKDRCSF1RPDGFRBLCK
SCHEMBL25913399 0.81 CSF1R (0.39) MEN1KMT2AKDRCSF1RPDGFRB
SCHEMBL25914718 0.80 KDR (0.38) GAAMAPTTHRBCYP3A4MEN1
SCHEMBL25914740 0.78 CSF1R (0.35) MAPTMEN1KMT2ACSF1RPDGFRB
SCHEMBL25910288 0.78 CSF1R (0.41) MAPTCYP3A4MEN1KMT2AKDR
SCHEMBL25913293 0.78 CSF1R (0.52) KDRCSF1RPDGFRBLCKKIT
SCHEMBL25914852 0.77 CSF1R (0.40) KDRCSF1RPDGFRBLCKKIT

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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