SCHEMBL8555050

SCHEMBL8555050

Cc1ccc(C)c(-c2oc(Cc3ccccc3)nc2-c2ccccc2S(N)(=O)=O)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
HPGD P15428 1/20 0.39
RXRA P19793 3/20 0.38
RXRB P28702 3/20 0.38
RXRG P48443 2/20 0.38
NR4A2 P43354 2/20 0.38
MAOB P27338 1/20 0.36
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KLKB1 P03952 1/20 0.35
USP2 O75604 1/20 0.34
MAPK10 P53779 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA9 Q16790 1/20 0.34
MEN1 O00255 1/20 0.34

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
SCHEMBL8556756 0.96 NPC1 (0.39) NPC1RAB9ASMN1; SMN2HPGDRXRA
SCHEMBL8556349 0.92 RXRA (0.38) NPC1RAB9ASMN1; SMN2HPGDRXRA
SCHEMBL8555763 0.90 RXRA (0.46) NPC1RAB9ASMN1; SMN2HPGDRXRA
SCHEMBL8554839 0.90 RXRA (0.38) NPC1RAB9ASMN1; SMN2HPGDRXRA
SCHEMBL8558684 0.88 RXRA (0.46) NPC1RAB9ASMN1; SMN2HPGDRXRA
SCHEMBL8561430 0.88 ALOX5AP (0.40) NPC1RAB9ASMN1; SMN2RXRARXRB
SCHEMBL8556716 0.88 NR4A2 (0.38) NPC1RAB9ASMN1; SMN2HPGDRXRA
SCHEMBL8560576 0.86 RXRA (0.46) NPC1RAB9ASMN1; SMN2HPGDRXRA
SCHEMBL8559362 0.86 ALOX5AP (0.40) NPC1RAB9ASMN1; SMN2RXRARXRB
SCHEMBL8555966 0.86 CA12 (0.37) NPC1RAB9ASMN1; SMN2HPGDRXRA

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