SCHEMBL27734682

SCHEMBL27734682

CCc1[nH]c2ccc(C(=O)O)cc2c1C

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.67
ALDH1A1 P00352 2/20 0.67
THRB P10828 1/20 0.67
HPGD P15428 1/20 0.67
TBXAS1 P24557 1/20 0.60
TDP1 Q9NUW8 2/20 0.52
PSMD14 O00487 1/20 0.52
RECQL P46063 1/20 0.52
RXFP1 Q9HBX9 1/20 0.52
HCRTR1 O43613 2/20 0.51
CYP19A1 P11511 1/20 0.50
PPARG P37231 1/20 0.49
APEX1 P27695 1/20 0.49
MAPT P10636 4/20 0.47
SIRT1 Q96EB6 1/20 0.47
KIF11 P52732 1/20 0.47
TP53 P04637 1/20 0.46
PTPN5 P54829 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
L3MBTL1 Q9Y468 2/20 0.45

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
SCHEMBL2161298 0.84 HCRTR1 (0.74) KDM4EALDH1A1HPGDHCRTR1CYP19A1
SCHEMBL7348472 0.84 APEX1 (0.62) KDM4EALDH1A1THRBHPGDTBXAS1
SCHEMBL11406941 0.83 KDM4E (0.57) KDM4EALDH1A1THRBHPGDTBXAS1
SCHEMBL10980413 0.83 KDM4E (0.57) KDM4EALDH1A1THRBHPGDTBXAS1
SCHEMBL7080072 0.80 KDM4E (0.75) KDM4EALDH1A1THRBHPGDTBXAS1
SCHEMBL1586810 0.80 KDM4E (1.00) KDM4EALDH1A1THRBHPGDTDP1
SCHEMBL8318727 0.79 KDM4E (0.56) KDM4EALDH1A1THRBHPGDTBXAS1
SCHEMBL25811506 0.78 KDM4E (0.67) KDM4EALDH1A1THRBHPGDTDP1
SCHEMBL6256720 0.76 KDM4E (0.46) KDM4EALDH1A1THRBHPGDTBXAS1
SCHEMBL10853051 0.76 TBXAS1 (0.55) KDM4EALDH1A1THRBHPGDTBXAS1

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
CN-101384550-B Amide derivative or salt thereof ASTELLAS PHARMA INC 2011-08-31 CN disclosed
CN-101384550-A Amide derivative or salt thereof ASTELLAS PHARMA INC (JP) 2009-03-11 CN disclosed