SCHEMBL9325873

SCHEMBL9325873

CC(C)(C)c1cc2ccccc2c(C(=O)O)c1O.[Cr]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA3 O75311 1/20 0.64
GLRB P48167 1/20 0.64
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
CYP1A2 P05177 2/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
KDM4E B2RXH2 1/20 0.56
GLA P06280 1/20 0.56
CYP2C19 P33261 1/20 0.56
HSD17B10 Q99714 1/20 0.56
ME2 P23368 1/20 0.48
ME1 P48163 1/20 0.48
ME3 Q16798 1/20 0.48
CYP3A4 P08684 1/20 0.43
STAT6 P42226 1/20 0.43
HIF1A Q16665 1/20 0.43
GAA P10253 2/20 0.42
DHODH Q02127 3/20 0.42
PDE10A Q9Y233 1/20 0.42

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
SCHEMBL19195723 0.98 GLRA3 (0.66) GLRA3GLRBMEN1KMT2ACYP1A2
SCHEMBL22623597 0.86 MEN1 (0.53) GLRA3GLRBMEN1KMT2ACYP1A2
SCHEMBL7717501 0.85 CYP1A2 (0.53) GLRA3GLRBMEN1KMT2ACYP1A2
SCHEMBL22166902 0.84 CYP1A2 (0.51) GLRA3GLRBMEN1KMT2ACYP1A2
SCHEMBL9325870 0.83 GLRA3 (0.45) GLRA3GLRBMEN1KMT2ACYP1A2
SCHEMBL23139694 0.81 MEN1 (0.56) GLRA3GLRBMEN1KMT2ACYP1A2
SCHEMBL17323554 0.79 ALDH1A1 (0.53) GLRA3GLRBMEN1KMT2ACYP1A2
SCHEMBL2791325 0.79 GLRA3 (1.00) GLRA3GLRBMEN1KMT2ACYP1A2
SCHEMBL19196664 0.78 CA2 (0.45) MEN1KMT2ACYP1A2ALDH1A1HPGD
SCHEMBL340402 0.77 CYP1A2 (0.63) MEN1KMT2ACYP1A2ALDH1A1HPGD

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-0420197-B1 Image forming method and image forming apparatus CANON KK (JP) 1994-03-02 EP disclosed