SCHEMBL11273369

SCHEMBL11273369

[O-][S+]1CCCCNc2ccccc2C1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL11266164 0.95 ALOX15 (0.36) ALOX15HSD17B10CA12CA1CA2
SCHEMBL13849613 0.87 ALOX15 (0.38) ALOX15HSD17B10MEN1ALDH1A1GAA
SCHEMBL11280879 0.72 AHR (0.36) ALOX15HSD17B10CA12CA1CA2
SCHEMBL11267164 0.72 CA12 (0.35) ALOX15HSD17B10CA12CA1CA2
SCHEMBL11269163 0.72 MAPT (0.35) ALOX15HSD17B10CA12CA1CA2
SCHEMBL9630852 0.71 MEN1 (0.32) MEN1ALDH1A1GAAKMT2A
SCHEMBL24119 0.71 TSHR (0.52) ALOX15HSD17B10CA12CA1CA2
SCHEMBL28370547 0.71 TSHR (0.52) ALOX15HSD17B10CA12CA1CA2
SCHEMBL29373532 0.71 TSHR (0.52) ALOX15HSD17B10CA12CA1CA2
SCHEMBL11260147 0.70 PNMT (0.36) CA12CA1CA2CA9

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
US-4328238-A ANTIDEPRESSANTS, ANTISECRETORY, AND ANTIULCER AGENTS SANKYO COMPANY LIMITED (JP) 1982-05-04 US disclosed