SCHEMBL7575797

SCHEMBL7575797

NCCCN1CCCC(Cc2ccc(F)cc2)C1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 14/20 0.53
CYP2D6 P10635 6/20 0.53
HTR2A P28223 2/20 0.51
CARM1 Q86X55 1/20 0.49
PRMT6 Q96LA8 1/20 0.49
MAOB P27338 1/20 0.47

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
SCHEMBL6333210 1.00 CCR3 (0.53) CCR3CYP2D6HTR2ACARM1PRMT6
SCHEMBL6972028 0.87 MAOB (0.64) CCR3CYP2D6HTR2AMAOB
SCHEMBL6217711 0.83 PRMT3 (0.59) CCR3CARM1PRMT6
SCHEMBL9703008 0.81 MEN1 (0.49) MAOB
SCHEMBL7247710 0.80 CARM1 (0.61) CCR3CARM1PRMT6MAOB
Hydrochloric Acid SCHEMBL9555682 0.80 MEN1 (0.48) MAOB
Bromide SCHEMBL7249132 0.79 CARM1 (0.60) CCR3CARM1PRMT6MAOB
SCHEMBL21216506 0.78 CYP2D6 (0.47) CCR3CYP2D6CARM1PRMT6MAOB
SCHEMBL12090432 0.78 CYP2D6 (0.47) CCR3CYP2D6CARM1PRMT6MAOB
SCHEMBL6986640 0.78 CYP2D6 (0.47) CCR3CYP2D6CARM1PRMT6MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1161240-A4 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARM CO (US) 2002-04-03 EP disclosed
EP-1161240-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY Du Pont Pharmaceuticals Company (US) 2001-12-12 EP disclosed
WO-2000035452-A1 N-UREIDOALKYL-PIPERIDINES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY DU PONT PHARMACEUTICALS COMPANY (US) 2000-06-22 WO disclosed