SCHEMBL8553792

SCHEMBL8553792

COc1c(Cl)cccc1-c1oc(Cc2ccccc2)nc1NS(=O)(=O)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.40
ALDH1A1 P00352 5/20 0.40
POLB P06746 1/20 0.40
LMNA P02545 2/20 0.39
CCR4 P51679 1/20 0.38
KDM4E B2RXH2 5/20 0.37
RXFP1 Q9HBX9 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
GGT1 P19440 1/20 0.37
PGR P06401 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.36
SLC40A1 Q9NP59 3/20 0.36
HSD17B10 Q99714 1/20 0.36
KMT2A Q03164 1/20 0.36
NAT1 P18440 1/20 0.35

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
SCHEMBL8559481 0.88 ALDH1A1 (0.40) MAPTALDH1A1POLBLMNACCR4
SCHEMBL8559341 0.88 MAPT (0.44) MAPTALDH1A1LMNAKDM4ERXFP1
SCHEMBL8555536 0.87 ALDH1A1 (0.42) MAPTALDH1A1POLBLMNAKDM4E
SCHEMBL8555914 0.85 MAPT (0.43) MAPTALDH1A1POLBLMNACCR4
SCHEMBL8559800 0.85 SLC40A1 (0.45) MAPTALDH1A1POLBLMNACCR4
SCHEMBL8555336 0.84 MAPT (0.44) MAPTALDH1A1POLBLMNACCR4
SCHEMBL8555983 0.84 ALDH1A1 (0.45) MAPTALDH1A1LMNAKDM4EGGT1
SCHEMBL8555293 0.83 PIK3CG (0.43) MAPTALDH1A1POLBLMNAKDM4E
SCHEMBL8560392 0.83 MAPT (0.44) MAPTALDH1A1LMNAKDM4ERXFP1
SCHEMBL8556141 0.82 KAT6A (0.46) MAPTALDH1A1POLBLMNAPGR

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