SCHEMBL12320049

SCHEMBL12320049

CC(=O)c1ccc(-c2ccc3c(c2)C(=O)OC(C)(C)O3)cc1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
HSD17B1 P14061 3/20 0.41
MAOB P27338 1/20 0.40
HDAC2 Q92769 1/20 0.39
KIF11 P52732 2/20 0.38
TDP2 O95551 1/20 0.38
ALDH1A1 P00352 2/20 0.37
MMP2 P08253 1/20 0.37
MMP9 P14780 1/20 0.37
MMP8 P22894 1/20 0.37
HPGD P15428 1/20 0.37
PGR P06401 1/20 0.36
CHEK1 O14757 1/20 0.36
S100A4 P26447 1/20 0.36
KDM4E B2RXH2 1/20 0.35

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
SCHEMBL15059366 0.88 S100A4 (0.46) MAPTSMN1; SMN2ALDH1A1HPGDS100A4
SCHEMBL1811733 0.79 RAB9A (0.49) MAPTTDP2ALDH1A1HPGD
SCHEMBL2412345 0.78 ELANE (0.40) KIF11ALDH1A1
SCHEMBL3555266 0.74 PTPN1 (0.43) SMN1; SMN2ALDH1A1KDM4E
SCHEMBL2472619 0.73 MAPT (0.57) MAPTSMN1; SMN2MAOBALDH1A1HPGD
SCHEMBL7153475 0.73 KDM4E (0.50) MAPTSMN1; SMN2KIF11ALDH1A1HPGD
SCHEMBL15799957 0.72 FTO (0.52) MAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL734522 0.72 KDM4E (0.47) MAPTSMN1; SMN2MAOBALDH1A1KDM4E
Acetic Acid SCHEMBL2470427 0.70 SMN1; SMN2 (0.38) MAPTSMN1; SMN2ALDH1A1HPGDKDM4E
SCHEMBL3524389 0.70 ALDH1A1 (0.44) MAPTALDH1A1S100A4KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1828107-B1 HYDROXYBIPHENYL CARBOXYLIC ACIDS AND DERIVATIVES, METHOD FOR PRODUCING THE SAME AND THEIR USE SANOFI AVENTIS DEUTSCHLAND (DE) 2011-09-28 EP disclosed