SCHEMBL8554061

SCHEMBL8554061

Cc1cccc(Cl)c1-c1nc(Cc2ccccc2)oc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
MAPT P10636 3/20 0.48
LMNA P02545 2/20 0.47
EDNRA P25101 5/20 0.43
EDNRB P24530 4/20 0.43
SLC40A1 Q9NP59 4/20 0.41
TSHR P16473 2/20 0.39
GAA P10253 2/20 0.39
HTT P42858 2/20 0.39
PGR P06401 1/20 0.39
PKM P14618 2/20 0.38
HSD17B10 Q99714 2/20 0.38
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
LIMK2 P53671 1/20 0.38
ALOX15 P16050 1/20 0.37

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
SCHEMBL8560355 0.92 ALDH1A1 (0.53) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8560073 0.92 ALDH1A1 (0.50) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8558287 0.87 ALDH1A1 (0.48) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8557580 0.87 ALDH1A1 (0.46) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8556381 0.86 ALDH1A1 (0.47) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8557399 0.84 MAPT (0.49) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8558680 0.84 ALDH1A1 (0.52) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8559268 0.84 MAPT (0.42) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8558062 0.83 ALDH1A1 (0.47) ALDH1A1MAPTLMNAEDNRAEDNRB
SCHEMBL8559259 0.83 MAPT (0.47) ALDH1A1MAPTLMNAEDNRAEDNRB

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-5719163-A ARTHRITIS G.D. SEARLE & CO. (US) 1998-02-17 US disclosed