SCHEMBL27323802

SCHEMBL27323802

CC(C)NC[C@@H]1CCCN(C(C)C)C1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 4/20 0.37
CCR2 P41597 1/20 0.37
CYP2D6 P10635 7/20 0.33
GHSR Q92847 5/20 0.33
KAT2B Q92831 1/20 0.33
DRD2 P14416 1/20 0.33
DRD3 P35462 1/20 0.33
HTT P42858 1/20 0.31
DPP4 P27487 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
SCHEMBL17827393 1.00 KCNH2 (0.37) KCNH2CCR2CYP2D6GHSRKAT2B
SCHEMBL26949296 1.00 KCNH2 (0.37) KCNH2CCR2CYP2D6GHSRKAT2B
SCHEMBL17788463 0.91 HRH3 (0.34) KCNH2CCR2HTT
SCHEMBL3316366 0.85 KCNH2 (0.37) KCNH2CCR2CYP2D6GHSRKAT2B
SCHEMBL3317300 0.85 KCNH2 (0.37) KCNH2CCR2CYP2D6GHSRKAT2B
SCHEMBL3316369 0.85 KCNH2 (0.37) KCNH2CCR2CYP2D6GHSRKAT2B
SCHEMBL24535944 0.82 KCNH2 (0.38) KCNH2CCR2CYP2D6GHSRKAT2B
SCHEMBL27323728 0.82 KCNH2 (0.36) KCNH2CCR2CYP2D6GHSRKAT2B
SCHEMBL27323725 0.82 KCNH2 (0.36) KCNH2CCR2CYP2D6GHSRKAT2B
SCHEMBL27323721 0.82 KCNH2 (0.36) KCNH2CCR2CYP2D6GHSRKAT2B

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-2023244918-A1 QUINOLONE BCL6 BIFUNCTIONAL DEGRADERS Treeline Biosciences, Inc. (US) 2023-12-21 WO disclosed