SCHEMBL9303663

SCHEMBL9303663

CC(C)(Oc1ccc(NC(=O)Nc2cc(Cl)ccc2Cl)cc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
MAPT P10636 3/20 0.57
PPARA Q07869 2/20 0.57
CYP1A2 P05177 2/20 0.57
CYP3A4 P08684 2/20 0.57
CYP2D6 P10635 2/20 0.57
CYP2C19 P33261 2/20 0.57
GRIK1 P39086 9/20 0.55
CA12 O43570 1/20 0.54
CA1 P00915 1/20 0.54
CA2 P00918 1/20 0.54
CA9 Q16790 1/20 0.54
FABP2 P12104 1/20 0.51
PPARG P37231 1/20 0.51
SLC22A12 Q96S37 1/20 0.51
PDGFRA P16234 1/20 0.50
KDR P35968 1/20 0.50
LMNA P02545 2/20 0.47
NPSR1 Q6W5P4 1/20 0.47

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
SCHEMBL9303086 0.90 MAPT (0.57) MEN1KMT2AMAPTPPARACYP1A2
SCHEMBL9131125 0.88 PPARA (0.52) MEN1KMT2AMAPTPPARACYP1A2
SCHEMBL1306107 0.86 PPARA (0.60) MEN1KMT2AMAPTPPARACYP1A2
SCHEMBL9561356 0.85 MAPT (0.67) MEN1KMT2AMAPTPPARACYP1A2
SCHEMBL1305530 0.85 PPARA (0.55) MEN1KMT2AMAPTPPARACYP1A2
SCHEMBL1304565 0.85 EPHX1 (0.59) MEN1KMT2AMAPTPPARACYP1A2
SCHEMBL1304985 0.84 CA12 (0.60) MEN1KMT2AMAPTCA12CA1
SCHEMBL806016 0.83 PPARA (0.50) MEN1KMT2AMAPTPPARACYP1A2
SCHEMBL16303954 0.83 PPARA (0.61) MEN1KMT2AMAPTPPARACYP1A2
SCHEMBL805971 0.83 PPARA (0.61) MEN1KMT2AMAPTPPARACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5292935-A Carboxyalkoxy-substituted diphenylurea MONTEFIORE MEDICAL CENTER (US) 1994-03-08 US disclosed
US-5093367-A Arylureidophenoxymethylpropionic acids which have activity in dissociation of oxygen from hemoglobin MONTEFIORE MEDICAL CENTER (US) 1992-03-03 US disclosed
EP-0420930-A4 METHOD OF SYNTHESIS AND NOVEL COMPOUNDS FOR PHARMACEUTICAL USES 1991-12-04 EP disclosed
EP-0420930-A1 METHOD OF SYNTHESIS AND NOVEL COMPOUNDS FOR PHARMACEUTICAL USES LALEZARI, Iraj (US) 1991-04-10 EP disclosed
US-4921997-A Method of synthesis and novel compounds for pharmaceutical uses MONTEFIORE MEDICAL CENTER (US) 1990-05-01 US disclosed
WO-1989012622-A1 METHOD OF SYNTHESIS AND NOVEL COMPOUNDS FOR PHARMACEUTICAL USES LALEZARI IRAJ (US) 1989-12-28 WO disclosed