SCHEMBL10697723

SCHEMBL10697723

N#Cc1ccccc1-c1ccccc1-c1ccccc1C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
ALOX12 P18054 1/20 0.47
ALDH1A1 P00352 3/20 0.46
ALOX15 P16050 1/20 0.46
ESR2 Q92731 1/20 0.46
EIF4E P06730 1/20 0.45
GAA P10253 1/20 0.45
MYC P01106 1/20 0.44
BRS3 P32247 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
FOLH1 Q04609 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.42
PPIA P62937 1/20 0.42
USP8 P40818 1/20 0.42
USP7 Q93009 1/20 0.42
HNF4A P41235 1/20 0.42
KMT2A Q03164 1/20 0.41
HTT P42858 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
SCHEMBL1343584 0.98 CYP3A4 (0.49) CYP3A4CYP2C9ALOX12ALDH1A1ALOX15
Acrylic Acid SCHEMBL22345854 0.89 CYP3A4 (0.41) CYP3A4CYP2C9ALOX12ALDH1A1ALOX15
Bicarbonate SCHEMBL7256331 0.84 ESR2 (0.55) ALDH1A1ESR2GAAL3MBTL1PPIA
SCHEMBL7559438 0.82 AKR1C3 (0.48) CYP2C9ALDH1A1ESR2GAAMAPT
SCHEMBL29365220 0.82 ALDH1A1 (0.56) ALDH1A1ALOX15GAALMNAMAPT
SCHEMBL180853 0.82 ALDH1A1 (0.56) ALDH1A1ALOX15GAALMNAMAPT
SCHEMBL25309551 0.82 XDH (0.46) EIF4EHTT
SCHEMBL30620175 0.82 ALDH1A1 (0.68) CYP3A4CYP2C9ALOX12ALDH1A1ALOX15
SCHEMBL2830888 0.82 ALDH1A1 (0.68) CYP3A4CYP2C9ALOX12ALDH1A1ALOX15
Water SCHEMBL27395300 0.82 ALDH1A1 (0.68) CYP3A4CYP2C9ALOX12ALDH1A1ALOX15

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
JP-54041284-A None JP disclosed
EP-0266136-A2 Ferroelectric liquid crystal cells STC PLC (GB) 1988-05-04 EP disclosed
JP-S5441284-A NEMATIC LIQUID CRYSTAL SEIKO EPSON CORP 1979-04-02 JP disclosed