SCHEMBL25912711

SCHEMBL25912711

CCCC1CCCN1c1ncc(-c2ccc3cc(Oc4ccnc(N)c4)ccc3n2)c(=O)n1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAF1 P04049 1/20 0.35
▸ BRAF P15056 1/20 0.35
▸ CSF1R P07333 2/20 0.34
▸ PDGFRB P09619 2/20 0.34
▸ KCNH2 Q12809 12/20 0.33
▸ HRH3 Q9Y5N1 12/20 0.33
▸ LCK P06239 1/20 0.33
▸ KIT P10721 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ PDGFRA P16234 1/20 0.33
▸ FLT3 P36888 1/20 0.33
▸ PTK6 Q13882 1/20 0.33
▸ SCN9A Q15858 1/20 0.32
▸ NR1I2 O75469 1/20 0.31
▸ SMARCA2 P51531 1/20 0.31
▸ SMARCA4 P51532 1/20 0.31
▸ NR1H2 P55055 1/20 0.31
▸ NR1H3 Q13133 1/20 0.31
▸ PBRM1 Q86U86 1/20 0.31
▸ FGFR1 P11362 2/20 0.30

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
SCHEMBL25910282 0.91 TLR7 (0.34) CSF1RPDGFRBKCNH2HRH3LCK
SCHEMBL25910179 0.83 CSF1R (0.37) CSF1RPDGFRBKCNH2HRH3LCK
SCHEMBL25911492 0.82 TLR7 (0.34) CSF1RPDGFRBKCNH2HRH3LCK
SCHEMBL25911473 0.79 CSF1R (0.48) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25909902 0.79 CSF1R (0.48) CSF1RPDGFRBLCKKITCYP2C9
SCHEMBL25910174 0.78 ADORA2A (0.44) BRAFCSF1RPDGFRBPDGFRA
SCHEMBL25910294 0.77 CSF1R (0.55) RAF1BRAFCSF1RPDGFRBLCK
SCHEMBL25910288 0.76 CSF1R (0.41) RAF1BRAFCSF1RPDGFRBLCK
SCHEMBL25910028 0.75 CSF1R (0.53) RAF1BRAFCSF1RPDGFRBLCK
SCHEMBL25911490 0.75 KCNH2 (0.37) KCNH2HRH3

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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