SCHEMBL8554064

SCHEMBL8554064

Cc1cccc(Cl)c1-c1nc(Cc2ccccc2)oc1-c1ccccc1S(N)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 6/20 0.40
NR4A2 P43354 6/20 0.39
RXRB P28702 5/20 0.38
RXRG P48443 2/20 0.38
NPC1 O15118 1/20 0.38
HPGD P15428 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
NR4A1 P22736 1/20 0.37
NR4A3 Q92570 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA6 P23280 2/20 0.34
CA7 P43166 2/20 0.34
CA13 Q8N1Q1 2/20 0.34
FAAH O00519 1/20 0.33

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
SCHEMBL8560078 0.94 NR4A2 (0.41) RXRANR4A2RXRBRXRGNR4A1
SCHEMBL8560361 0.93 RXRA (0.46) RXRANR4A2RXRBRXRGNPC1
SCHEMBL8559272 0.92 NPC1 (0.38) RXRANR4A2RXRBRXRGNPC1
SCHEMBL8556383 0.89 NR4A2 (0.39) RXRANR4A2RXRBRXRGNPC1
SCHEMBL8557583 0.88 RXRA (0.40) RXRANR4A2RXRBRXRGNR4A1
SCHEMBL8558290 0.88 RXRA (0.40) RXRANR4A2RXRBRXRGNPC1
SCHEMBL8560396 0.87 NR4A2 (0.40) RXRANR4A2RXRBRXRGNR4A1
SCHEMBL8557401 0.87 NR4A2 (0.46) RXRANR4A2RXRBRXRGSMN1; SMN2
SCHEMBL8558684 0.87 RXRA (0.46) RXRANR4A2RXRBRXRGNPC1
SCHEMBL8555541 0.87 NR4A2 (0.39) RXRANR4A2RXRBRXRGNPC1

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