SCHEMBL25340911

SCHEMBL25340911

CN1C=NS(=O)(=O)c2cc(-c3nccnc3Sc3ccc(C(F)(F)F)cc3)ccc21

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ TRPV1 Q8NER1 1/20 0.31
▸ KDM2B Q8NHM5 1/20 0.30
▸ KDM4C Q9H3R0 1/20 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
SCHEMBL30544147 1.00 CYP1A2 (0.33) CYP1A2CYP3A4GAACYP2D6CYP2C9
SCHEMBL30544125 0.78 CA12 (0.35) TRPV1
SCHEMBL25339908 0.78 CA12 (0.35) TRPV1
SCHEMBL25955304 0.77 CYP1A2 (0.33) CYP1A2CYP3A4GAACYP2D6CYP2C9
SCHEMBL30544079 0.74 GPR142 (0.36) CYP1A2CYP3A4GAACYP2D6CYP2C9
SCHEMBL25339990 0.74 GPR142 (0.36) CYP1A2CYP3A4GAACYP2D6CYP2C9
SCHEMBL25973977 0.71 TRPV1 (0.39) CYP1A2CYP3A4GAACYP2D6CYP2C9
SCHEMBL25429595 0.70 TRPV1 (0.37) CYP1A2CYP3A4GAACYP2D6CYP2C9
SCHEMBL30544122 0.70 TRPV1 (0.37) CYP1A2CYP3A4GAACYP2D6CYP2C9
SCHEMBL25954052 0.70 TRPV1 (0.37) CYP1A2CYP3A4GAACYP2D6CYP2C9

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-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
WO-2023146511-A1 COMPOUNDS AND METHODS OF USE THEREOF VIVACE THERAPEUTICS, INC. (US) 2023-08-03 — — WO disclosed
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