SCHEMBL2429586

SCHEMBL2429586

CC1(C)CCC(N2CC[CH]CC2)CC1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 5/20 0.36
OPRM1 P35372 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
SCHEMBL19132723 0.78 OPRL1 (0.50) OPRL1
SCHEMBL14662046 0.78 HRH3 (0.36) OPRL1
SCHEMBL574979 0.78
SCHEMBL12774192 0.76 HRH3 (0.37) OPRL1OPRM1
SCHEMBL19132728 0.75 RORC (0.36) OPRL1OPRM1
SCHEMBL4825714 0.74 HTR6 (0.41) OPRL1OPRM1
SCHEMBL736256 0.74 SLC18A3 (0.42)
SCHEMBL18202930 0.74 HRH3 (0.33) OPRL1OPRM1
SCHEMBL735809 0.74 L3MBTL3 (0.38)
SCHEMBL1394992 0.73 L3MBTL1 (0.41)

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-104768948-B Alternatively 4- formamido group-isoindoline ketone derivatives of property PARP-1 inhibitor 内尔维阿诺医学科学有限公司 2018-11-27 CN disclosed
EP-2549874-A1 SUBSTITUTED IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS BETA-SECRETASE INHIBITORS High Point Pharmaceuticals, LLC (US) 2013-01-30 EP disclosed
WO-2011119465-A1 SUBSTITUTED IMIDAZO[1,2-B]PYRIDAZINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND METHODS OF USE AS BETA-SECRETASE INHIBITORS HIGH POINT PHARMACEUTICALS, LLC (US) 2011-09-29 WO disclosed