SCHEMBL9047840

SCHEMBL9047840

O=C1C/C(=C\c2ccccc2)C(=O)O1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.53
ALDH1A1 P00352 4/20 0.52
F3 P13726 1/20 0.50
MAOB P27338 6/20 0.49
MAOA P21397 3/20 0.49
MIF P14174 2/20 0.49
HTT P42858 1/20 0.48
HPGD P15428 3/20 0.44
KDM4E B2RXH2 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
AKT1 P31749 2/20 0.44
AKT2 P31751 2/20 0.44
AKT3 Q9Y243 2/20 0.44
MAPT P10636 3/20 0.43
MGAM O43451 1/20 0.42
GAA P10253 1/20 0.42
SI P14410 1/20 0.42
MGAM2 Q2M2H8 1/20 0.42
STK17B O94768 1/20 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
SCHEMBL6660533 1.00 CYP1A2 (0.53) CYP1A2ALDH1A1F3MAOBMAOA
SCHEMBL7399707 1.00 CYP1A2 (0.53) CYP1A2ALDH1A1F3MAOBMAOA
SCHEMBL9049098 0.83 KMT2A (0.51) CYP1A2ALDH1A1MAOBMAOAMIF
SCHEMBL9047782 0.83 AKR1C3 (0.50) CYP1A2MAOBMAOA
SCHEMBL9047523 0.83 AKR1C3 (0.50) CYP1A2MAOBMAOA
SCHEMBL9049105 0.83 KMT2A (0.51) CYP1A2ALDH1A1MAOBMAOAMIF
SCHEMBL16246446 0.80 STK17B (0.54) CYP1A2ALDH1A1F3MAOBMAOA
SCHEMBL16246447 0.80 STK17B (0.54) CYP1A2ALDH1A1F3MAOBMAOA
SCHEMBL1657949 0.79 NFE2L2 (0.58) CYP1A2ALDH1A1MAOBMAOATDP1
SCHEMBL1655146 0.79 HSD11B1 (0.61) CYP1A2ALDH1A1MAOBMAOAHTT

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