SCHEMBL8640440

SCHEMBL8640440

O=C(Cc1cccs1)NCCS

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HPGD P15428 8/20 0.68
ALDH1A1 P00352 2/20 0.68
POLB P06746 3/20 0.61
RAB9A P51151 2/20 0.60
KDM4E B2RXH2 1/20 0.59
PKM P14618 1/20 0.59
TSHR P16473 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.56
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
CA1 P00915 1/20 0.56
CA2 P00918 1/20 0.56
CA5A P35218 1/20 0.56
CA7 P43166 1/20 0.56
CA5B Q9Y2D0 1/20 0.56
NPC1 O15118 1/20 0.55
ALOX15 P16050 1/20 0.54
HSD17B10 Q99714 1/20 0.54

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
SCHEMBL4682348 0.83 HPGD (0.68) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL18542949 0.83 ALDH1A1 (0.70) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL9263148 0.82 HPGD (0.66) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL11704529 0.81 HPGD (0.74) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL28879832 0.81 ALDH1A1 (0.80) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL9282371 0.80 HPGD (0.62) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL8319802 0.79 HPGD (0.72) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL10546402 0.78 HPGD (0.70) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL11627330 0.78 HPGD (0.70) HPGDALDH1A1POLBRAB9AKDM4E
SCHEMBL11077045 0.78 HPGD (0.70) HPGDALDH1A1POLBRAB9AKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5756822-A ANTIULCER KAKEN PHARMACEUTICAL CO., LTD. (JP) 1998-05-26 US disclosed
US-5672597-A ANTIULCER AGENT KAKEN PHARMACEUTICAL CO., LTD. (JP) 1997-09-30 US disclosed
EP-0673925-A1 ACETAMIDE DERIVATIVE KAKEN PHARMACEUTICAL CO., LTD. (JP) 1995-09-27 EP disclosed