SCHEMBL10782836

SCHEMBL10782836

OCc1cc(-c2ccc(Cl)cc2)cc(CO)c1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.47
AHR P35869 2/20 0.45
HIF1A Q16665 2/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
NOTUM Q6P988 5/20 0.41
CYP1A2 P05177 1/20 0.39
ERN1 O75460 1/20 0.39
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
IKBKB O14920 1/20 0.38
CHUK O15111 1/20 0.38
MEN1 O00255 1/20 0.38
SLC22A1 O15245 1/20 0.38
USP2 O75604 1/20 0.38

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
SCHEMBL835866 0.82 KDM4E (0.46) CYP2C9CYP2C19CYP3A4HPGDTTR
SCHEMBL10900598 0.79 SHBG (0.42) MEN1HPGDKMT2AESR1KDM4E
SCHEMBL2121614 0.78 PTPN1 (0.52) ALOX5CYP2C9CYP2C19CYP1A2CYP3A4
SCHEMBL1004123 0.77 CYP2C9 (0.50) HIF1ACYP2C9CYP2C19CYP1A2ERN1
SCHEMBL7673877 0.76 ALOX5 (0.44) ALOX5AHRNOTUMCYP1A2CYP3A4
SCHEMBL2851608 0.75 ALDH1A1 (0.41) ALOX5CYP2C9CYP2C19ERN1MEN1
SCHEMBL11780214 0.75 AKR1C2 (0.54) CYP2C9CYP2C19LMNAHSP90AA1CYP3A4
SCHEMBL16581437 0.74 MEN1 (0.44) CYP2C9CYP2C19MEN1CYP3A4KMT2A
SCHEMBL23486768 0.73 PTPN1 (0.61) ALOX5CYP2C9CYP2C19CYP1A2CYP3A4
SCHEMBL3566720 0.73 TTR (0.70) ALOX5AHRHIF1ACYP2C9CYP2C19

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-0117759-B1 POLYNUCLEAR POLYHYDRIC PHENOLS AND PROCESS FOR PREPARATION THEREOF MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1987-09-30 EP disclosed
US-4614826-A CURABLE TO EPOXY RESINS; HEAT RESISTANCE MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1986-09-30 US disclosed
EP-0117759-A1 Polynuclear polyhydric phenols and process for preparation thereof MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1984-09-05 EP disclosed