SCHEMBL11501019

SCHEMBL11501019

CCC(=O)c1ccc(C)cc1CCOS(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.41
CTDSP1 Q9GZU7 1/20 0.41
SIRT5 Q9NXA8 1/20 0.41
LMNA P02545 3/20 0.39
HTT P42858 1/20 0.39
CHRNA7 P36544 1/20 0.39
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
PSMD10 O75832 1/20 0.37
KMT2A Q03164 5/20 0.36
ALDH1A1 P00352 3/20 0.36
TSHR P16473 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TP53 P04637 1/20 0.36
P4HB P07237 1/20 0.36
MAPK1 P28482 1/20 0.36
PAX8 Q06710 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL8560757 0.75 CA1 (0.42) STAT3CTDSP1SIRT5LMNACA12
SCHEMBL9838573 0.74 HSP90AB1 (0.43) LMNACHRNA7KMT2AALDH1A1HSD11B1
SCHEMBL24951911 0.74 CA12 (0.45) STAT3CTDSP1SIRT5LMNACA12
SCHEMBL9838536 0.73 TAAR1 (0.53) CHRNA7KMT2AHSP90AB1MEN1POLB
SCHEMBL15227216 0.72 LMNA (0.51) STAT3CTDSP1SIRT5LMNAHTT
SCHEMBL241884 0.72 CA1 (0.52) STAT3LMNAHTTCA12CA1
SCHEMBL28774223 0.71 MEN1 (0.46) STAT3CTDSP1SIRT5LMNACA12
SCHEMBL16619075 0.71 CA12 (0.39) STAT3CTDSP1SIRT5HTTCA12
SCHEMBL18289524 0.71 CA1 (0.50) STAT3CA12CA1CA9KMT2A
SCHEMBL6906905 0.71 CA1 (0.50) STAT3CA12CA1CA9KMT2A

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-4192818-A ANTIDEPRESSANTS DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1980-03-11 US disclosed