SCHEMBL31203134

SCHEMBL31203134

CNC(=O)c1cc(-c2ccc(Cn3ccc4c(F)ccc(C(=O)NC5CC6(CCC6)C5)c43)cc2)ccn1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 13/20 0.43
▸ CNR1 P21554 4/20 0.39
▸ BMPR1B O00238 1/20 0.38
▸ BMPR1A P36894 1/20 0.38
▸ TGFBR1 P36897 1/20 0.38
▸ ACVRL1 P37023 1/20 0.38
▸ ACVR1 Q04771 1/20 0.38
▸ HSD11B1 P28845 4/20 0.37
▸ PI4KB Q9UBF8 1/20 0.36
▸ BRD4 O60885 1/20 0.35

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
SCHEMBL31203150 0.92 CNR2 (0.42) CNR2CNR1BMPR1BBMPR1ATGFBR1
SCHEMBL21458145 0.91 PTGER4 (0.38) CNR2CNR1HSD11B1PI4KBBRD4
SCHEMBL21481846 0.91 PTGER4 (0.38) CNR2CNR1HSD11B1PI4KBBRD4
SCHEMBL31203681 0.91 PTGER4 (0.38) CNR2CNR1HSD11B1PI4KBBRD4
SCHEMBL31203194 0.91 CNR2 (0.46) CNR2CNR1BMPR1BBMPR1ATGFBR1
SCHEMBL31203155 0.89 CNR2 (0.43) CNR2CNR1BMPR1BBMPR1ATGFBR1
SCHEMBL31203176 0.88 CNR2 (0.42) CNR2CNR1BMPR1BBMPR1ATGFBR1
SCHEMBL31203156 0.88 CNR2 (0.43) CNR2CNR1BMPR1BBMPR1ATGFBR1
SCHEMBL31203151 0.88 CNR2 (0.43) CNR2CNR1BMPR1BBMPR1ATGFBR1
SCHEMBL21481843 0.86 BRD4 (0.40) CNR2CNR1PI4KBBRD4

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
EP-3781550-B1 BICYCLIC CARBOXAMIDES AND METHODS OF USE THEREOF TEMPEST THERAPEUTICS INC (US) 2024-10-30 — — EP claimed
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