SCHEMBL10489709

SCHEMBL10489709

CC(C)Cc1cccc(NC(=O)Oc2ccccc2)c1C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.45
▸ KMT2A Q03164 6/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ GAA P10253 2/20 0.45
▸ LMNA P02545 2/20 0.45
▸ TP53 P04637 1/20 0.45
▸ TRPV1 Q8NER1 1/20 0.44
▸ ELANE P08246 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ KDM4E B2RXH2 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ CYP1A2 P05177 2/20 0.42
▸ HPGD P15428 2/20 0.41
▸ GLA P06280 1/20 0.41
▸ ATM Q13315 1/20 0.41
▸ GFER P55789 2/20 0.41
▸ CCNE1 P24864 1/20 0.41
▸ CDK2 P24941 1/20 0.41

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
SCHEMBL15223404 0.88 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1GAALMNA
SCHEMBL10489876 0.87 RAB9A (0.50) ALDH1A1KMT2AMEN1GAATRPV1
SCHEMBL10489756 0.87 HPGD (0.44) ALDH1A1KMT2AMEN1LMNARAB9A
SCHEMBL10489704 0.83 TRPV1 (0.45) ALDH1A1KMT2AMEN1GAATRPV1
SCHEMBL10489664 0.83 ALDH1A1 (0.50) ALDH1A1KMT2AMEN1LMNANPC1
SCHEMBL10489745 0.82 NPC1 (0.56) ALDH1A1ELANENPC1RAB9AMAPT
SCHEMBL10489862 0.81 MAPK1 (0.46) ALDH1A1KMT2AMEN1LMNANPC1
SCHEMBL10489667 0.81 PPARA (0.49) TRPV1NPC1RAB9ANPSR1
SCHEMBL10489762 0.80 ALDH1A1 (0.49) ALDH1A1KMT2AMEN1GAALMNA
SCHEMBL10489802 0.80 PPARA (0.54) KDM4EMAPT

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-4873232-A ARTHRITIS AND AUTOIMMUNE DISEASES SYNTEX (US) 1989-10-10 — — US disclosed
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