SCHEMBL8800926

SCHEMBL8800926

CC(Cc1cccs1)N1CN(C(C)Cc2cccs2)CN(C(C)Cc2cccs2)C1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 1/20 0.46
▸ RAB9A P51151 4/20 0.44
▸ LMNA P02545 4/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ GAA P10253 1/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ HTT P42858 5/20 0.40
▸ TAAR1 Q96RJ0 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ SLC6A3 Q01959 1/20 0.37

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
SCHEMBL8802066 0.76 CYP2C19 (0.49) CYP2C19RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL91135 0.76 — —
SCHEMBL1425401 0.72 — —
SCHEMBL2326001 0.72 — —
SCHEMBL14520624 0.72 — —
SCHEMBL25238974 0.72 — —
SCHEMBL21038290 0.72 CYP2C19 (0.52) CYP2C19RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL22295329 0.72 CYP2C19 (0.52) CYP2C19RAB9ALMNASMN1; SMN2L3MBTL1
SCHEMBL21498153 0.72 — —
SCHEMBL6682630 0.72 — —

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
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
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