SCHEMBL8993329

SCHEMBL8993329

CC(OC(=O)Nc1ccccc1C(=O)O)SC1c2cc(Cl)ccc2-c2ccc(Cl)cc21

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NHERF1 O14745 1/20 0.42
KDM4E B2RXH2 4/20 0.41
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
GRIK1 P39086 6/20 0.41
HSD17B10 Q99714 1/20 0.41
DHODH Q02127 1/20 0.40
ALDH1A1 P00352 2/20 0.39
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
HPGD P15428 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 1/20 0.39
SERPINE1 P05121 2/20 0.39
SUCNR1 Q9BXA5 1/20 0.39
GAA P10253 1/20 0.39

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
SCHEMBL29293878 0.72 KDM4E (0.63) KDM4ERAB9AHSD17B10ALDH1A1MEN1
SCHEMBL7835189 0.66 KDM4E (0.49) KDM4ERAB9ANPC1DHODHALDH1A1
SCHEMBL29293884 0.66 KDM4E (0.71) KDM4EHSD17B10ALDH1A1MEN1LMNA
SCHEMBL5594687 0.66 KDM4E (0.68) KDM4ERAB9ANPC1GRIK1DHODH
SCHEMBL3629659 0.65 KMT2A (0.57) KDM4ERAB9ANPC1DHODHALDH1A1
SCHEMBL1157612 0.65 EPHX2 (0.57) KDM4EHSD17B10KMT2ASERPINE1GAA
SCHEMBL11603203 0.64 FABP4 (0.69) KDM4EGRIK1HSD17B10DHODHALDH1A1
SCHEMBL11637217 0.64 MAPT (0.57) ALDH1A1MEN1LMNAKMT2AGAA
SCHEMBL29293876 0.63 HPGD (0.54) KDM4ERAB9ANPC1HSD17B10ALDH1A1
SCHEMBL4912839 0.63 TSHR (0.66) KDM4EDHODHALDH1A1MEN1LMNA

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-5519043-A ANTIINFLAMMATORY AGENTS WITH AMIDE, CARBAMATE OR THIOCARBAMATE GROUPS ON FLUORENE AND BENZENE SCIOS NOVA INC. (US) 1996-05-21 US claimed