SCHEMBL19012408

SCHEMBL19012408

COc1ccc(C(C)CC(C)(C)c2ccc(OC)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
MAPK1 P28482 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
TSHR P16473 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
ABCB11 O95342 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
CA14 Q9ULX7 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
AOC3 Q16853 4/20 0.40
NPSR1 Q6W5P4 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL21671652 0.82 NPC1 (0.49) ALDH1A1MAPK1MAPTCYP2D6NPC1
SCHEMBL10794218 0.81 TSHR (0.43) TSHRMAPTNPC1RAB9A
SCHEMBL10716629 0.80 MAPT (0.63) ALDH1A1MAPK1TDP1TSHRMAPT
SCHEMBL10629492 0.80 GRIA4 (0.33) ALDH1A1TSHRMAPTNPC1RAB9A
SCHEMBL3151324 0.79 MAPT (0.49) ALDH1A1MAPK1TDP1MAPTCYP1A2
SCHEMBL12384045 0.79 PDE2A (0.43) CA1CA2
SCHEMBL3480352 0.79 SHBG (0.52) ALDH1A1TDP1TSHRMAPTCYP1A2
SCHEMBL23512911 0.77 MAOB (0.40) ALDH1A1MAPK1TDP1MAPTGAA
SCHEMBL4454111 0.76 CA1 (0.52) ALDH1A1MAPK1TDP1TSHRL3MBTL1
SCHEMBL22291711 0.76 CA1 (0.52) ALDH1A1MAPK1TDP1TSHRL3MBTL1

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-20170174833-A1 HIGH-FLUIDITY POLYCARBONATE COPOLYMER, PROCESS FOR PRODUCTION HIGHLY POLYMERIZED AROMATIC POLYCARBONATE RESIN AND AROMATIC POLYCARBONATE COMPOUND MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2017-06-22 US disclosed