SCHEMBL8559359

SCHEMBL8559359

Cc1ccc(-c2nc(Cc3ccccc3)oc2NS(=O)(=O)c2ccccc2)c(F)c1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
MAPT P10636 2/20 0.47
MALT1 Q9UDY8 1/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.40
HPGD P15428 1/20 0.39
METAP2 P50579 1/20 0.39
SLC40A1 Q9NP59 2/20 0.39
EDNRB P24530 3/20 0.38
EDNRA P25101 3/20 0.38
ITK Q08881 1/20 0.38
KIT P10721 1/20 0.37
KDM4E B2RXH2 1/20 0.37
FFAR4 Q5NUL3 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
SCHEMBL8560599 0.90 MAPT (0.46) ALDH1A1MAPTLMNATSHRSLC40A1
SCHEMBL8554836 0.90 ALDH1A1 (0.48) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL8555963 0.88 ALDH1A1 (0.47) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL8556753 0.88 ALDH1A1 (0.48) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL8556318 0.87 ALDH1A1 (0.44) ALDH1A1MAPTLMNATSHRSLC40A1
SCHEMBL8560513 0.87 MAPT (0.49) ALDH1A1MAPTLMNAHPGDSLC40A1
SCHEMBL8559711 0.86 MAPT (0.47) ALDH1A1MAPTLMNATSHRSLC40A1
SCHEMBL8555122 0.84 ALDH1A1 (0.47) ALDH1A1MAPTLMNATSHRHPGD
SCHEMBL8561427 0.84 ALDH1A1 (0.42) ALDH1A1MAPTMALT1LMNATSHR
SCHEMBL8555187 0.83 MAPT (0.46) ALDH1A1MAPTLMNATSHRSLC40A1

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