SCHEMBL10665201

SCHEMBL10665201

CCCCCC1=NCC(O)O1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.42
SPHK2 Q9NRA0 4/20 0.31
SPHK1 Q9NYA1 4/20 0.31
THRA P10827 1/20 0.30
THRB P10828 1/20 0.30
LIPG Q9Y5X9 1/20 0.30
SCD O00767 1/20 0.30

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
SCHEMBL6260210 0.79 EPHX2 (0.40) EPHX2
SCHEMBL15201426 0.78 EPHX2 (0.42) EPHX2SPHK1THRATHRB
SCHEMBL15201428 0.78 EPHX2 (0.42) EPHX2SPHK1THRATHRB
SCHEMBL15201541 0.78 EPHX2 (0.42) EPHX2SPHK1THRATHRB
SCHEMBL3477521 0.70 EPHX2 (0.33) EPHX2
SCHEMBL4278055 0.67 SPHK2 (0.33) SPHK2SPHK1THRATHRB
SCHEMBL8046993 0.66 EPHX2 (0.34) EPHX2SPHK1THRATHRB
SCHEMBL2362491 0.63 F10 (0.37) SPHK2SPHK1THRATHRBSCD
Methyl Alcohol SCHEMBL11182681 0.63 SCD (0.33) EPHX2SCD
SCHEMBL251101 0.63 ADRA2A (0.32)

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
CN-109642009-A SILANE-FUNCTIONAL POLYMERIC POLYURETHANES 科思创德国股份有限公司 2019-04-16 CN disclosed
US-4754010-A Oxazoline containing polymers ASHLAND OIL, INC. (US) 1988-06-28 US disclosed
US-4709040-A Oxazoline containing multifunctional monomer ASHLAND OIL, INC. (US) 1987-11-24 US disclosed