SCHEMBL8635784

SCHEMBL8635784

C=C(C)C(=O)OCC(O)CN(Cc1cccc(CN(CC(O)COC(=O)C(=C)C)CC(O)COc2ccccc2)c1)CC(O)COc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.56
ALDH1A1 P00352 3/20 0.50
TSHR P16473 1/20 0.50
MAPT P10636 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
NPSR1 Q6W5P4 1/20 0.48
GAA P10253 1/20 0.46
MAPK1 P28482 1/20 0.46
KCNH2 Q12809 1/20 0.42
HIF1A Q16665 1/20 0.41
ABCB1 P08183 3/20 0.41
PRMT5 O14744 1/20 0.41
WDR77 Q9BQA1 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 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
SCHEMBL8429142 0.92 POLB (0.59) POLBALDH1A1TSHRMAPTCYP1A2
SCHEMBL7034449 0.91 TSHR (0.42) POLBALDH1A1TSHRMAPTCYP1A2
SCHEMBL7031407 0.86 POLB (0.39) POLBALDH1A1TSHRMAPTCYP1A2
SCHEMBL7029230 0.86 POLB (0.39) POLBALDH1A1TSHRMAPTCYP1A2
SCHEMBL7029895 0.86 POLB (0.39) POLBALDH1A1TSHRMAPTCYP1A2
SCHEMBL2720963 0.82 TSHR (0.47) POLBTSHRMAPTCYP2D6NPSR1
SCHEMBL219561 0.82 MAPT (0.51) POLBTSHRMAPTCYP1A2CYP2D6
SCHEMBL8429322 0.82 POLB (0.37) POLBALDH1A1TSHRMAPTCYP1A2
SCHEMBL7021371 0.81 TSHR (0.45) POLBALDH1A1TSHRMAPTCYP1A2
SCHEMBL28559612 0.81 POLB (0.46) POLBALDH1A1TSHRMAPTCYP1A2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5811210-A PHOTOSENSITIVE LAYER AND SILICONE RUBBER LAYER LAMINATED IN ORDER ONTO A SUBSTRATE; PEEL BONDING STRENGTH AND ELASTIC MODULUS; FOR WEB OFFSET AND NEWSPAPER OFFSET PRINTING DURABILITY TORAY INDUSTRIES, INC. (JP) 1998-09-22 US disclosed
EP-0583860-B1 Dry planographic printing plate TORAY INDUSTRIES (JP) 1998-07-22 EP disclosed
US-5397681-A Laminate used for the production of a dry planographic printing plate TORAY INDUSTRIES, INC. (JP) 1995-03-14 US disclosed
EP-0583860-A2 Dry planographic printing plate TORAY INDUSTRIES, INC. (JP) 1994-02-23 EP disclosed