SCHEMBL25342234

SCHEMBL25342234

CNS(=O)(=O)c1cc(-c2cccnc2Sc2ccc(C(F)(F)F)cc2)ccc1O

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 4/20 0.41
▸ FEN1 P39748 4/20 0.41
▸ FTO Q9C0B1 1/20 0.40
▸ COMT P21964 2/20 0.39
▸ ERAP1 Q9NZ08 1/20 0.36
▸ SLC40A1 Q9NP59 2/20 0.35
▸ KLRK1 P26718 1/20 0.35
▸ MICA Q29983 1/20 0.35
▸ RAET1L Q5VY80 1/20 0.35
▸ TRPV1 Q8NER1 4/20 0.35
▸ TLR7 Q9NYK1 1/20 0.34
▸ TNNI3K Q59H18 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ P2RX1 P51575 1/20 0.34

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
SCHEMBL25341479 0.87 ALPL (0.46) ALOX5APFEN1SMN1; SMN2
SCHEMBL25341077 0.86 ALOX5AP (0.38) ALOX5APFEN1FTOCOMTERAP1
SCHEMBL30519329 0.86 ALOX5AP (0.38) ALOX5APFEN1FTOCOMTERAP1
SCHEMBL25339100 0.81 LMNA (0.43) ALOX5APFEN1FTOCOMTERAP1
SCHEMBL30519237 0.76 ALOX5AP (0.43) ALOX5APFEN1ERAP1TRPV1P2RX1
SCHEMBL30519397 0.76 MMP13 (0.35) FTOCOMTERAP1TRPV1SMN1; SMN2
SCHEMBL25339584 0.76 MMP13 (0.35) FTOCOMTERAP1TRPV1SMN1; SMN2
SCHEMBL25341566 0.76 ALOX5AP (0.43) ALOX5APFEN1ERAP1TRPV1P2RX1
SCHEMBL25340680 0.74 WDR5 (0.39) TRPV1
SCHEMBL30519324 0.74 WDR5 (0.39) TRPV1

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