SCHEMBL9511115

SCHEMBL9511115

CCCCCOC(C)CCCCC(C)O

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.39
DNM1 Q05193 1/20 0.38
EPHX2 P34913 1/20 0.38
FAAH O00519 5/20 0.38
TDP1 Q9NUW8 1/20 0.37
OPRM1 P35372 1/20 0.37
LPAR1 Q92633 4/20 0.37
LPAR3 Q9UBY5 4/20 0.37
CNR1 P21554 1/20 0.37
CNR2 P34972 1/20 0.37
LPAR2 Q9HBW0 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
SCHEMBL8979925 0.98 SPHK1 (0.42) SPHK1DNM1EPHX2FAAHLPAR1
SCHEMBL9508665 0.98 SPHK1 (0.42) SPHK1DNM1EPHX2FAAHLPAR1
SCHEMBL9508761 0.98 SPHK1 (0.42) SPHK1DNM1EPHX2FAAHLPAR1
SCHEMBL9508060 0.96 DNM1 (0.38) SPHK1DNM1EPHX2TDP1LPAR1
SCHEMBL9507530 0.90 DNM1 (0.39) SPHK1DNM1EPHX2FAAHTDP1
SCHEMBL14380991 0.89 DNM1 (0.45) SPHK1DNM1EPHX2FAAHOPRM1
SCHEMBL9507424 0.88 DNM1 (0.42) SPHK1DNM1EPHX2FAAHTDP1
SCHEMBL9511188 0.88 DNM1 (0.42) SPHK1DNM1EPHX2FAAHTDP1
SCHEMBL9508720 0.88 DNM1 (0.42) SPHK1DNM1EPHX2FAAHTDP1
SCHEMBL9509848 0.88 DNM1 (0.42) SPHK1DNM1EPHX2FAAHTDP1

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
EP-0388960-B1 OPTICALLY ACTIVE COMPOUNDS AND THEIR PREPARATION AND USE HITACHI, LTD. (JP) 1993-10-06 EP disclosed
US-5152919-A Stability, chemical resistance, high speed response, large spo ntaneous polarization, molecular orientation and wide temperat ure range HITACHI, LTD. (JP) 1992-10-06 US disclosed
EP-0388960-A1 Optically active compounds and their preparation and use HITACHI, LTD. (JP) 1990-09-26 EP disclosed