SCHEMBL30519393

SCHEMBL30519393

NC(=O)c1ccc(-c2nccnc2Oc2ccc(C(F)(F)F)cc2)cc1O

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 2/20 0.47
▸ KIF11 P52732 1/20 0.42
▸ SCN9A Q15858 9/20 0.41
▸ FPR2 P25090 2/20 0.41
▸ CHEK2 O96017 1/20 0.41
▸ CASP1 P29466 1/20 0.41
▸ MKNK1 Q9BUB5 1/20 0.41
▸ MKNK2 Q9HBH9 1/20 0.41
▸ RAB9A P51151 1/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MAPT P10636 1/20 0.39

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
SCHEMBL25341793 1.00 TRPV1 (0.47) TRPV1KIF11SCN9AFPR2CHEK2
SCHEMBL25340735 0.85 MKNK1 (0.42) KIF11SCN9AFPR2CHEK2CASP1
SCHEMBL30519468 0.83 SCN9A (0.41) KIF11SCN9AFPR2CHEK2MKNK1
SCHEMBL25340768 0.83 SCN9A (0.41) KIF11SCN9AFPR2CHEK2MKNK1
SCHEMBL25340543 0.80 SCN9A (0.41) SCN9AFPR2CHEK2MKNK1MKNK2
SCHEMBL30519343 0.80 SCN9A (0.41) SCN9AFPR2CHEK2MKNK1MKNK2
SCHEMBL25973972 0.80 TRPV1 (0.39) TRPV1RAB9A
SCHEMBL25973973 0.79 THRB (0.41) TRPV1SCN9ARAB9ASMN1; SMN2
SCHEMBL25974745 0.78 KIF11 (0.51) KIF11RAB9ASMN1; SMN2KDM4EMAPT
SCHEMBL30519279 0.76 LMNA (0.39) TRPV1KIF11SMN1; SMN2MAPT

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-2023146513-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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