SCHEMBL5201411

SCHEMBL5201411

CC1=C(C(=O)O)C(c2ccc(-c3ccccc3-c3ccccc3)o2)C2=C(CCCC2=O)N1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.58
KDM4E B2RXH2 4/20 0.58
MAPT P10636 1/20 0.58
FFAR3 O14843 12/20 0.57
SMN1; SMN2 Q16637 4/20 0.56
LMNA P02545 2/20 0.56
TSHR P16473 2/20 0.51
GAA P10253 1/20 0.51
TP53 P04637 1/20 0.51
HPGD P15428 1/20 0.51
HSD17B10 Q99714 1/20 0.51

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
SCHEMBL5064866 0.87 FFAR3 (0.76) KDM4EFFAR3SMN1; SMN2
SCHEMBL3263495 0.86 ALDH1A1 (0.54) ALDH1A1KDM4EMAPTFFAR3SMN1; SMN2
SCHEMBL3263202 0.85 ALDH1A1 (0.55) ALDH1A1KDM4EMAPTFFAR3SMN1; SMN2
O-Tolylamine SCHEMBL5315045 0.80 FFAR3 (0.52) ALDH1A1KDM4EMAPTFFAR3SMN1; SMN2
SCHEMBL5202041 0.77 FFAR3 (0.76) ALDH1A1KDM4EMAPTFFAR3SMN1; SMN2
SCHEMBL5197527 0.77 FFAR3 (0.60) ALDH1A1KDM4EFFAR3SMN1; SMN2LMNA
SCHEMBL14010782 0.73 FFAR3 (0.63) ALDH1A1KDM4EMAPTFFAR3SMN1; SMN2
SCHEMBL3004453 0.73 KDM4E (0.64) ALDH1A1KDM4ESMN1; SMN2LMNATSHR
SCHEMBL2998553 0.73 SMN1; SMN2 (0.72) ALDH1A1KDM4ESMN1; SMN2LMNATSHR
SCHEMBL15866579 0.73 FFAR3 (0.62) ALDH1A1KDM4EMAPTFFAR3SMN1; SMN2

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-1812080-A2 GPR41 AND MODULATORS THEREOF FOR THE TREATMENT OF INSULIN-RELATED DISORDERS Arena Pharmaceuticals, Inc. (US) 2007-08-01 EP claimed
WO-2006052566-A2 GPR41 AND MODULATORS THEREOF FOR THE TREATMENT OF INSULIN-RELATED DISORDERS ARENA PHARMACEUTICALS, INC. (US) 2006-05-18 WO claimed
EP-1812080-B1 GPR41 AND MODULATORS THEREOF FOR THE TREATMENT OF INSULIN-RELATED DISORDERS ARENA PHARM INC (US) 2014-07-09 EP disclosed
EP-1812080-A2 GPR41 AND MODULATORS THEREOF FOR THE TREATMENT OF INSULIN-RELATED DISORDERS Arena Pharmaceuticals, Inc. (US) 2007-08-01 EP disclosed
WO-2006052566-A2 GPR41 AND MODULATORS THEREOF FOR THE TREATMENT OF INSULIN-RELATED DISORDERS ARENA PHARMACEUTICALS, INC. (US) 2006-05-18 WO disclosed