SCHEMBL8802018

SCHEMBL8802018

CC(c1cccs1)C(Cc1ccccc1)Oc1nc(OC(Cc2ccccc2)C(C)c2cccs2)nc(OC(Cc2ccccc2)C(C)c2cccs2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
SLC6A2 P23975 4/20 0.38
SLC6A4 P31645 3/20 0.38
SLC6A3 Q01959 3/20 0.38
TAAR1 Q96RJ0 2/20 0.38
MAOA P21397 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
CYP2A6 P11509 1/20 0.38
ADORA2A P29274 1/20 0.38
ADORA1 P30542 1/20 0.38
PPARG P37231 1/20 0.34
PPARA Q07869 1/20 0.34
TSHR P16473 5/20 0.34
KMT2A Q03164 3/20 0.34
MEN1 O00255 2/20 0.34
RBP1 P09455 1/20 0.34
HPGD P15428 1/20 0.33
MLNR O43193 1/20 0.33
CACNA1F O60840 1/20 0.33

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
SCHEMBL9570349 0.77 MEN1 (0.41) LMNASLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL8801566 0.73 SLC6A2 (0.48) SLC6A2SLC6A4SLC6A3TAAR1MAOA
SCHEMBL8801211 0.73 TRPA1 (0.46) SLC6A2SLC6A4SLC6A3TAAR1MAOA
Hydrochloric Acid SCHEMBL8800673 0.72 SLC6A2 (0.47) SLC6A2SLC6A4SLC6A3TAAR1MAOA
SCHEMBL8800929 0.71 TSHR (0.41) LMNASLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL8800678 0.71 TSHR (0.42) LMNASLC6A2SLC6A4SLC6A3TAAR1
SCHEMBL8800892 0.68 PPARG (0.39) LMNAL3MBTL1PPARGPPARATSHR
SCHEMBL8801053 0.68 TDP1 (0.38) LMNAL3MBTL1SLC6A2SLC6A4SLC6A3
SCHEMBL7362430 0.67 TAAR1 (0.40) LMNAL3MBTL1SLC6A2SLC6A4SLC6A3
SCHEMBL3906596 0.67 SLC5A2 (0.52) PPARGPPARATSHRKMT2ACYP1A2

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