SCHEMBL9437836

SCHEMBL9437836

Cc1ccc(S(=O)(=O)NCCN(C)CCc2ccc3c(c2)sc(=O)n3C)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
ALDH1A1 P00352 8/20 0.47
KDM4E B2RXH2 3/20 0.47
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
SIGMAR1 Q99720 3/20 0.44
THRB P10828 1/20 0.43
CA12 O43570 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
ALOX15 P16050 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
HSD17B10 Q99714 1/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL9437754 0.93 MAPT (0.48) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL9437772 0.88 HSD17B10 (0.51) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL9437785 0.83 TSHR (0.49) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL9437692 0.76 SIGMAR1 (0.51) SIGMAR1
SCHEMBL8109725 0.76 SIGMAR1 (0.53) SIGMAR1
SCHEMBL8109064 0.76 SIGMAR1 (0.51) SIGMAR1
SCHEMBL8110589 0.76 SIGMAR1 (0.51) SIGMAR1
Hydrochloric Acid SCHEMBL8870196 0.75 SIGMAR1 (0.50) SIGMAR1
Hydrochloric Acid SCHEMBL8870179 0.75 SIGMAR1 (0.50) SIGMAR1
Hydrochloric Acid SCHEMBL8870580 0.75 SIGMAR1 (0.52) SIGMAR1

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
US-5296477-A Antidepressants ADIR ET COMPAGNIE (FR) 1994-03-22 US disclosed
US-5268381-A Antidepressant or anxiolytic compound ADIR ET COMPAGNIE (FR) 1993-12-07 US disclosed