SCHEMBL10656281

SCHEMBL10656281

CCC(Oc1ccc2c(-c3ccc(C)s3)noc2c1Cl)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 12/20 0.38
PPARG P37231 11/20 0.35
PPARD Q03181 10/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PTGDR2 Q9Y5Y4 2/20 0.33
NPSR1 Q6W5P4 1/20 0.31
MMP2 P08253 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
MMP12 P39900 1/20 0.31
MMP13 P45452 1/20 0.31

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
SCHEMBL10656055 0.86 FABP3 (0.40) PPARAPPARGPPARDSMN1; SMN2NPSR1
SCHEMBL10659584 0.84 PPARA (0.41) PPARAPPARGPPARDSMN1; SMN2
SCHEMBL10658961 0.84 PPARA (0.48) PPARAPPARGPPARD
SCHEMBL10665132 0.83 PPARA (0.40) PPARAPPARGPPARDSMN1; SMN2PTGDR2
SCHEMBL10656039 0.83 PPARA (0.42) PPARAPPARGPPARD
SCHEMBL10658780 0.82 PPARA (0.37) PPARAPPARGPPARDSMN1; SMN2PTGDR2
SCHEMBL10657410 0.82 MAPT (0.41) PPARAPPARGPPARDSMN1; SMN2
SCHEMBL10658761 0.82 PPARA (0.39) PPARAPPARGPPARDSMN1; SMN2PTGDR2
SCHEMBL10659166 0.81 PPARA (0.37) PPARAPPARGPPARDSMN1; SMN2
SCHEMBL10662292 0.81 PPARG (0.42) PPARAPPARGPPARDNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4728662-A DIURETICS, URICOSURICS, HYPOTENSIVES HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-03-01 US disclosed
US-4673746-A DIURETICS, HYPOTENSIVES HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1987-06-16 US disclosed