SCHEMBL9507530

SCHEMBL9507530

CCCCCOC(C)CCC(C)O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
USP2 O75604 1/20 0.37
SPHK1 Q9NYA1 2/20 0.37
HTT P42858 1/20 0.36
EPHX2 P34913 1/20 0.36
CNR1 P21554 2/20 0.36
CNR2 P34972 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.35
MAPT P10636 1/20 0.35
FAAH O00519 1/20 0.34

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
SCHEMBL9508720 0.98 DNM1 (0.42) DNM1TDP1USP2SPHK1HTT
SCHEMBL9509848 0.98 DNM1 (0.42) DNM1TDP1USP2SPHK1HTT
SCHEMBL9509821 0.98 DNM1 (0.42) DNM1TDP1USP2SPHK1HTT
SCHEMBL9509804 0.98 DNM1 (0.42) DNM1TDP1USP2SPHK1HTT
SCHEMBL9507424 0.98 DNM1 (0.42) DNM1TDP1USP2SPHK1HTT
SCHEMBL9511188 0.98 DNM1 (0.42) DNM1TDP1USP2SPHK1HTT
SCHEMBL9511088 0.94 TDP1 (0.39) DNM1TDP1SPHK1EPHX2CNR1
SCHEMBL9509826 0.94 TDP1 (0.39) DNM1TDP1SPHK1EPHX2CNR1
SCHEMBL9511106 0.94 TDP1 (0.39) DNM1TDP1SPHK1EPHX2CNR1
SCHEMBL9511115 0.90 SPHK1 (0.39) DNM1TDP1SPHK1EPHX2CNR1

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