SCHEMBL7825970

SCHEMBL7825970

CC(C)(C)OC(=O)N1CCCC(O)(CN2CCC(Cc3ccc(F)cc3)CC2)C1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.46
TP53 P04637 2/20 0.46
CCR3 P51677 3/20 0.45
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
POLB P06746 1/20 0.41
OPRM1 P35372 1/20 0.41
MAPT P10636 1/20 0.40

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
SCHEMBL22397199 0.82 CNR1 (0.44) CNR1CNR2POLB
SCHEMBL21199085 0.82 CNR1 (0.44) CNR1CNR2POLB
SCHEMBL7822481 0.81 CCR3 (0.50) CCR3MAPT
SCHEMBL20015304 0.81 POLB (0.51) LMNATP53CCR3POLB
SCHEMBL4773466 0.80 TP53 (0.54) LMNATP53CCR3POLB
SCHEMBL21358915 0.76 CCR3 (0.51) CCR3POLB
SCHEMBL4149104 0.76 CCR3 (0.51) CCR3POLB
SCHEMBL23089360 0.75 MEN1 (0.39) CNR2MAPT
SCHEMBL23090111 0.74 USP2 (0.51) POLB
SCHEMBL17296109 0.73 NAMPT (0.48) LMNATP53CCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140834-A1 HETEROCYCLIC PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Du Pont Pharmaceuticals Company (US) 2001-10-10 EP disclosed
WO-2000035877-A1 HETEROCYCLIC PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARMACEUTICALS COMPANY (US) 2000-06-22 WO disclosed