SCHEMBL1406465

SCHEMBL1406465

CC(C)(C)c1cc(C(=O)/C=C/c2ccc(C(=O)O)cc2)cc(N2CCCCC2)c1OCc1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TNFRSF1A P19438 3/20 0.50
MAOB P27338 2/20 0.46
MAPT P10636 4/20 0.45
TDP1 Q9NUW8 4/20 0.45
MAPK1 P28482 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
TP53 P04637 2/20 0.45
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
BLM P54132 1/20 0.45
CASP7 P55210 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ABCG2 Q9UNQ0 1/20 0.45
APP P05067 2/20 0.42
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
RARA P10276 3/20 0.42
RARB P10826 3/20 0.42
RARG P13631 3/20 0.42

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
SCHEMBL1406467 1.00 TNFRSF1A (0.50) TNFRSF1AMAOBMAPTTDP1MAPK1
SCHEMBL1406852 0.92 TNFRSF1A (0.49) TNFRSF1AMAOBMAPTTDP1MAPK1
SCHEMBL1406855 0.92 TNFRSF1A (0.49) TNFRSF1AMAOBMAPTTDP1MAPK1
SCHEMBL1406612 0.84 RARA (0.41) HSD17B10APPRXRARXRBRXRG
SCHEMBL1406614 0.84 RARA (0.41) HSD17B10APPRXRARXRBRXRG
SCHEMBL1406860 0.82 TNFRSF1A (0.43) TNFRSF1AMAOBMAPK1HSD17B10ABCG2
SCHEMBL1406397 0.82 TNFRSF1A (0.43) TNFRSF1AMAOBMAPK1HSD17B10ABCG2
SCHEMBL1406700 0.79 TNFRSF1A (0.52) TNFRSF1AMAOBMAPTTDP1MAPK1
SCHEMBL1406702 0.79 TNFRSF1A (0.52) TNFRSF1AMAOBMAPTTDP1MAPK1
SCHEMBL1406474 0.76 MAPK1 (0.41) MAPTMAPK1HSD17B10RXRARXRB

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513793-B1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2011-03-09 EP claimed
US-20050131033-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-06-16 US claimed
EP-1513793-B1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RES & DEV (FR) 2011-03-09 EP disclosed
US-7468457-B2 Ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT (FR) 2008-12-23 US disclosed
US-20050131033-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2005-06-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050131033-A1 Novel ligand inhibitors of the RAR receptors, process for preparing same and therapeutic/cosmetic applications thereof RARA, RARB, RARG TNFRSF1A 87/4885MAOB 1897/4885MAPT 4711/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.