SCHEMBL7814247

SCHEMBL7814247

CC(C)(Oc1ccc(C2=CCN(C(=O)c3ccco3)CC2)cc1)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.53
KMT2A Q03164 5/20 0.53
TSHR P16473 4/20 0.53
POLB P06746 3/20 0.53
KDM4E B2RXH2 1/20 0.53
MEN1 O00255 1/20 0.53
PPARG P37231 2/20 0.49
PPARA Q07869 2/20 0.49
MAPT P10636 2/20 0.44
CRHBP P24387 1/20 0.44
CRHR2 Q13324 1/20 0.44
LMNA P02545 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
HPGD P15428 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MDM2 Q00987 1/20 0.42
SMN1; SMN2 Q16637 2/20 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
SCHEMBL7811217 0.90 PPARG (0.48) ALDH1A1KMT2ATSHRPOLBKDM4E
SCHEMBL7804727 0.84 PPARG (0.53) ALDH1A1KMT2APOLBMEN1PPARG
SCHEMBL7804408 0.81 PPARA (0.53) ALDH1A1KMT2APOLBMEN1PPARG
SCHEMBL7811809 0.80 NAMPT (0.57) ALDH1A1POLBKDM4EPPARGPPARA
SCHEMBL7811694 0.80 PPARG (0.52) ALDH1A1PPARGPPARASMN1; SMN2
SCHEMBL7810105 0.79 L3MBTL1 (0.68) ALDH1A1PPARGPPARALMNASMN1; SMN2
SCHEMBL7811461 0.79 NAMPT (0.52) ALDH1A1POLBPPARGPPARAMAPT
SCHEMBL7813924 0.79 PPARA (0.51) KMT2APOLBMEN1PPARGPPARA
SCHEMBL7817567 0.79 PPARA (0.64) ALDH1A1KMT2AMEN1PPARGPPARA
SCHEMBL7813581 0.79 PPARA (0.51) ALDH1A1KMT2APOLBMEN1PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0607536-B1 Arylamide derivatives SS PHARMACEUTICAL CO (JP) 2001-01-24 EP disclosed
US-5532371-A SIDE EFFECT REDUCTION SS PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5411972-A Arylamide derivatives for treating hyperlipemia SS PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
EP-0607536-A1 Arylamide derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1994-07-27 EP disclosed