SCHEMBL29348135

SCHEMBL29348135

CCN1CCNC(CC(C)C)C1

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 1/20 0.35
KCNH2 Q12809 1/20 0.35
PRKCQ Q04759 8/20 0.33
PRKCD Q05655 8/20 0.33
PRKCA P17252 4/20 0.32
PLG P00747 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
SCHEMBL292482 0.81 CCR2 (0.36) CCR2KCNH2
SCHEMBL1005313 0.81 MEN1 (0.34) PRKCQPRKCDPRKCA
SCHEMBL1007085 0.81 MEN1 (0.34) PRKCQPRKCDPRKCA
SCHEMBL3106378 0.80 CCR2 (0.38) CCR2KCNH2PRKCQPRKCD
SCHEMBL18898665 0.79 CCR2 (0.31) CCR2KCNH2
SCHEMBL13415927 0.77 CCR2 (0.36) CCR2KCNH2
SCHEMBL12337287 0.77 CCR2 (0.39) CCR2KCNH2
SCHEMBL9036872 0.77 CCR2 (0.36) CCR2KCNH2
SCHEMBL6962233 0.77 PRKCQ (0.34) PRKCQPRKCDPRKCAPLG
SCHEMBL18898612 0.77 CCR2 (0.30) CCR2KCNH2

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-2024141757-A1 LSD1 MODULATORS EXSCIENTIA AI LIMITED (GB) 2024-07-04 WO disclosed