SCHEMBL29317237

SCHEMBL29317237

CC(C)(C)C1CCN(C2CCC3(CC2)CN(CC2CCNCC2)C3)CC1

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
ALOX15 P16050 1/20 0.33
OPRM1 P35372 2/20 0.32
OPRK1 P41145 2/20 0.32
OPRL1 P41146 2/20 0.32
TRPV6 Q9H1D0 1/20 0.31
GBA1 P04062 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
SCHEMBL25856192 0.90 CYP1A2 (0.41) CYP1A2CYP2D6ALOX15OPRM1OPRK1
SCHEMBL25027108 0.85 ACHE (0.38) GBA1
SCHEMBL25856205 0.85 GBA1 (0.35) CYP2D6GBA1
SCHEMBL25856389 0.85 CYP1A2 (0.36) CYP1A2CYP2D6ALOX15OPRM1OPRK1
SCHEMBL24480701 0.81 GBA1 (0.40) TRPV6GBA1
SCHEMBL17471124 0.77 GNAO1 (0.41) GBA1
SCHEMBL12109922 0.75 KMT2A (0.36) CYP2D6OPRM1OPRK1OPRL1TRPV6
SCHEMBL29317239 0.75 ACHE (0.41) GBA1
SCHEMBL25856382 0.75 TACR1 (0.31)
SCHEMBL24480306 0.74 KMT2A (0.36) CYP2D6OPRM1OPRK1OPRL1TRPV6

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
EP-4397661-A1 COMPOUND FOR DEGRADATION OF BCL-2 FAMILY PROTEINS AND MEDICAL APPLICATION THEREOF Xizang Haisco Pharmaceutical Co., Ltd. (CN) 2024-07-10 EP disclosed