SCHEMBL9049685

SCHEMBL9049685

Cc1ccccc1C=C(CC(=O)O)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
CYP2C19 P33261 1/20 0.50
RECQL P46063 1/20 0.49
ALDH1A1 P00352 3/20 0.42
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
KDM4E B2RXH2 3/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GMNN O75496 1/20 0.39
LMNA P02545 1/20 0.39
PMP22 Q01453 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
ITGB3 P05106 2/20 0.38
ITGAV P06756 2/20 0.38
ITGB1 P05556 1/20 0.38
ITGA5 P08648 1/20 0.38
GAA P10253 3/20 0.37
TDP1 Q9NUW8 1/20 0.37
KMT2A Q03164 1/20 0.36

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
SCHEMBL9049678 1.00 TSHR (0.50) TSHRCYP2C19RECQLALDH1A1ERCC5
SCHEMBL17318680 0.85 RECQL (0.45) TSHRCYP2C19RECQLALDH1A1ERCC5
SCHEMBL17318678 0.85 RECQL (0.45) TSHRCYP2C19RECQLALDH1A1ERCC5
SCHEMBL17318679 0.85 RECQL (0.45) TSHRCYP2C19RECQLALDH1A1ERCC5
SCHEMBL24587500 0.84 ALDH1A1 (0.44) TSHRALDH1A1ERCC5FEN1KDM4E
SCHEMBL7947844 0.84 ALDH1A1 (0.44) TSHRALDH1A1ERCC5FEN1KDM4E
SCHEMBL7328215 0.77 KDM4E (0.51) TSHRCYP2C19RECQLALDH1A1KDM4E
SCHEMBL7328223 0.77 KDM4E (0.51) TSHRCYP2C19RECQLALDH1A1KDM4E
SCHEMBL2224096 0.76 RECQL (0.72) TSHRCYP2C19RECQLALDH1A1KDM4E
SCHEMBL7446722 0.76 ALDH1A1 (0.50) TSHRCYP2C19ALDH1A1KDM4ESMN1; 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0507534-B1 Succinic acid compounds KISSEI PHARMACEUTICAL (JP) 1996-02-28 EP disclosed
US-5202335-A Hypoglycemic, antidiabetic agents KISSEI PHARMACEUTICAL CO., LTD. (JP) 1993-04-13 US disclosed
EP-0507534-A1 Succinic acid compounds KISSEI PHARMACEUTICAL CO., LTD. (JP) 1992-10-07 EP disclosed