SCHEMBL7175258

SCHEMBL7175258

C#CC1(N(C)CCCCC)CCCC1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 3/20 0.35
OPRM1 P35372 1/20 0.33
OPRL1 P41146 1/20 0.33
SIGMAR1 Q99720 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
SCHEMBL26557740 0.66 OPRM1 (0.41) DNM1OPRM1OPRL1
SCHEMBL17351055 0.66 DNM1 (0.48) DNM1OPRM1OPRL1
SCHEMBL27769660 0.62
SCHEMBL14679618 0.60 DNM1 (0.52) DNM1
SCHEMBL24688639 0.60 OPRM1 (0.43) DNM1OPRM1OPRL1
SCHEMBL15486339 0.60 DNM1 (0.67) DNM1
SCHEMBL20544016 0.59 DNM1 (0.43) DNM1
SCHEMBL332622 0.59 DNM1 (0.44) DNM1
SCHEMBL8520421 0.57 DNM1 (0.48) DNM1
Cyclohexane SCHEMBL9836640 0.57 DNM1 (0.79) DNM1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1334094-A1 CHOLESTEROL LOWERING BENZO[B]THIOPHENES AND BENZO[D]ISOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2003-08-13 EP disclosed
WO-2002036584-A1 CHOLESTEROL LOWERING BENZO`B! THIOPHENES AND BENZO`D! ISOTHIAZOLES F. HOFFMANN-LA ROCHE AG (CH) 2002-05-10 WO disclosed