SCHEMBL2858633

SCHEMBL2858633

Cc1ccc(C(O)(O)O)c2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 5/20 0.59
CYP2A6 P11509 3/20 0.46
ALDH1A1 P00352 3/20 0.39
TSHR P16473 2/20 0.37
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
CYP2D6 P10635 2/20 0.36
CYP2C19 P33261 2/20 0.36
CYP3A4 P08684 1/20 0.36
HPGD P15428 4/20 0.35
KDM4E B2RXH2 4/20 0.35
MAPT P10636 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
HSD17B10 Q99714 2/20 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
SCHEMBL16852471 0.84 CYP1A2 (0.56) CYP1A2CYP2A6ALDH1A1TSHRGRIN2D
SCHEMBL16852472 0.79 KDM4E (0.54) CYP1A2ALDH1A1HPGDKDM4EMAPT
SCHEMBL7831783 0.79 CYP1A2 (0.62) CYP1A2CYP2A6ALDH1A1TSHRGRIN2D
SCHEMBL1538509 0.79 CYP1A2 (0.62) CYP1A2CYP2A6ALDH1A1TSHRGRIN2D
SCHEMBL1538917 0.77 CYP1A2 (0.59) CYP1A2CYP2A6ALDH1A1TSHRCYP2D6
SCHEMBL1538737 0.77 CYP1A2 (0.59) CYP1A2CYP2A6ALDH1A1TSHRGRIN2D
SCHEMBL161370 0.77 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1TSHRGRIN2D
SCHEMBL29447796 0.77 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1TSHRGRIN2D
SCHEMBL29363045 0.77 CYP1A2 (1.00) CYP1A2CYP2A6ALDH1A1TSHRGRIN2D
SCHEMBL20414568 0.74 IDO1 (0.48) CYP1A2CYP2A6ALDH1A1TSHRMEN1

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
US-20100247906-A1 HEAT-RESISTANT ADHESIVE SHEET TORAY SAEHAN INC. (KR) 2010-09-30 US disclosed
EP-2173829-A1 HEAT-RESISTANT ADHESIVE SHEET Toray Saehan Incorporated (KR) 2010-04-14 EP disclosed
WO-2009020253-A1 HEAT-RESISTANT ADHESIVE SHEET TORAY SAEHAN INC. (KR) 2009-02-12 WO disclosed