SCHEMBL24671071

SCHEMBL24671071

CC(C)N1CCC(CN2CCC3(CN(C)C3)C2)CC1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.35
OPRL1 P41146 1/20 0.35
OPRK1 P41145 1/20 0.33
HRH3 Q9Y5N1 4/20 0.32
EPHX2 P34913 1/20 0.31

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
SCHEMBL25480265 0.91 OPRM1 (0.36) OPRM1OPRL1OPRK1HRH3EPHX2
SCHEMBL25881815 0.89 OPRM1 (0.40) OPRM1OPRL1OPRK1HRH3EPHX2
SCHEMBL27307184 0.88 OPRM1 (0.38) OPRM1OPRL1OPRK1HRH3EPHX2
SCHEMBL26506541 0.88 OPRM1 (0.35) OPRM1OPRL1OPRK1EPHX2
SCHEMBL24475299 0.86 HRH3 (0.35) OPRM1OPRL1HRH3
SCHEMBL27290168 0.85 NCF1 (0.39) OPRM1OPRL1OPRK1EPHX2
SCHEMBL22520631 0.84 HRH3 (0.35) OPRM1OPRL1OPRK1HRH3
SCHEMBL24233214 0.83 HRH3 (0.35) OPRM1OPRL1OPRK1HRH3EPHX2
SCHEMBL22520604 0.82 HRH3 (0.36) OPRM1OPRL1OPRK1HRH3
SCHEMBL24475333 0.82 TSHR (0.36) OPRM1OPRL1OPRK1HRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022235715-A1 COMPOUNDS FOR INHIBITING OR DEGRADING ITK, COMPOSITIONS, COMPRISING THE SAME METHODS OF THEIR MAKING AND METHODS OF THEIR USE NURIX THERAPEUTICS, INC. (US) 2022-11-10 WO disclosed