SCHEMBL25429893

SCHEMBL25429893

O=c1cc[nH]c2cc(-c3nccnc3Oc3ccc(C(F)(F)F)cc3)ccc12

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.54
▸ TRPV1 Q8NER1 4/20 0.41
▸ TRPA1 O75762 1/20 0.39
▸ DRD1 P21728 3/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ MAOA P21397 2/20 0.36
▸ MAOB P27338 2/20 0.36
▸ TTBK1 Q5TCY1 1/20 0.36
▸ PIK3CA P42336 1/20 0.35
▸ BRAF P15056 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ MAPK14 Q16539 1/20 0.35
▸ TNNI3K Q59H18 1/20 0.35
▸ PDE10A Q9Y233 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
SCHEMBL25427626 0.86 HSD17B10 (0.51) HSD17B10TRPV1TRPA1ALDH1A1MAOA
SCHEMBL25429394 0.85 HSD17B10 (0.52) HSD17B10TRPV1TRPA1PDE10A
SCHEMBL25430317 0.80 HSD17B10 (0.53) HSD17B10TRPV1TRPA1ALDH1A1
SCHEMBL25430689 0.77 PDE10A (0.42) TRPV1MAOAMAOBPDE10A
SCHEMBL25429720 0.77 HSD17B10 (0.55) HSD17B10TRPV1ALDH1A1
SCHEMBL25340961 0.73 TRPV1 (0.45) TRPV1BRAFKDRMAPK14TNNI3K
SCHEMBL9400251 0.72 HSD17B10 (1.00) HSD17B10ALDH1A1
SCHEMBL25973973 0.72 THRB (0.41) TRPV1PDE10A
SCHEMBL25428892 0.72 TRPV1 (0.37) TRPV1PIK3CAPDE10A
SCHEMBL30544130 0.72 TRPV1 (0.37) TRPV1PIK3CAPDE10A

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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