SCHEMBL8802066

SCHEMBL8802066

CC(Cc1cccs1)n1c(=O)n(C(C)Cc2cccs2)c(=O)n(C(C)Cc2cccs2)c1=O

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.49
▸ RAB9A P51151 6/20 0.46
▸ MAPT P10636 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ NPC1 O15118 4/20 0.40
▸ CTSC P53634 3/20 0.40
▸ LMNA P02545 3/20 0.40
▸ GAA P10253 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ SMN1; SMN2 Q16637 4/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ HPGD P15428 2/20 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
SCHEMBL6634871 0.77 TDP1 (0.59) CYP2C19RAB9ANPC1CTSCLMNA
SCHEMBL8800926 0.76 CYP2C19 (0.46) CYP2C19RAB9AMAPTNPC1LMNA
SCHEMBL91135 0.74 — —
SCHEMBL14520624 0.71 — —
SCHEMBL21498153 0.71 — —
SCHEMBL25238974 0.71 — —
SCHEMBL21038290 0.71 CYP2C19 (0.52) CYP2C19RAB9AMAPTNPC1CTSC
SCHEMBL22295329 0.71 CYP2C19 (0.52) CYP2C19RAB9AMAPTNPC1CTSC
SCHEMBL6682630 0.71 — —
SCHEMBL2326001 0.71 — —

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
EP-0522956-B1 Preparation of 2-(2-thienyl) ethylamine and synthesis of thieno [3,2-C] pyridine derivatives therefrom SANOFI SA (FR) 1997-02-05 — — EP disclosed
EP-0522956-A2 Preparation of 2-(2-thienyl) ethylamine and synthesis of thieno [3,2-C] pyridine derivatives therefrom SANOFI (FR) 1993-01-13 — — EP disclosed
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