SCHEMBL9737267

SCHEMBL9737267

CC(C)(c1ccccc1O)c1ccccc1O.Oc1ccccc1Cc1ccccc1O

nearest known ligand 0.64

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.64
TSHR P16473 3/20 0.54
ALDH1A1 P00352 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
KEAP1 Q14145 1/20 0.47
CYP2D6 P10635 1/20 0.42
HIF1A Q16665 1/20 0.42
IDH1 O75874 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
AKR1B1 P15121 1/20 0.41
CA12 O43570 4/20 0.39
CA2 P00918 4/20 0.39
IDO1 P14902 2/20 0.39
CA9 Q16790 3/20 0.38
MPO P05164 1/20 0.38
HTR1A P08908 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL29613273 0.85 ALDH1A1 (0.71) HSPA5TSHRALDH1A1TDP1HIF1A
SCHEMBL584830 0.85 ALDH1A1 (0.71) HSPA5TSHRALDH1A1TDP1HIF1A
SCHEMBL146742 0.83 ALDH1A1 (0.68) HSPA5TSHRALDH1A1TDP1HIF1A
SCHEMBL982784 0.82 TSHR (0.52) HSPA5TSHRALDH1A1TDP1CYP2D6
SCHEMBL49745 0.80 HSPA5 (1.00) HSPA5TSHRALDH1A1TDP1KEAP1
SCHEMBL29357407 0.80 HSPA5 (1.00) HSPA5TSHRALDH1A1TDP1KEAP1
SCHEMBL986181 0.79 TSHR (0.48) HSPA5TSHRALDH1A1TDP1CYP2D6
SCHEMBL9752003 0.79 HSPA5 (0.57) HSPA5TSHRALDH1A1TDP1KEAP1
SCHEMBL22240432 0.78 TSHR (0.43) HSPA5TSHRALDH1A1TDP1KEAP1
SCHEMBL29839938 0.78 HSPA5 (0.94) HSPA5TSHRALDH1A1TDP1KEAP1

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
US-5130410-A Condencing a bishydroxymethyl phenol with a reactive phenol in the absence of an aldehyde to form an alternating copolymer and reacting in the presence of an aromatic aldehyde SHIPLEY COMPANY INC. (US) 1992-07-14 US claimed