SCHEMBL6620167

SCHEMBL6620167

CCc1cc(NC(=O)NCC[C@@H](CO)N2CC(Oc3ccc(F)cc3)C2)n(C)n1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CCR3 P51677 3/20 0.41
SCN9A Q15858 2/20 0.36
CCR1 P32246 1/20 0.35
TYRO3 Q06418 2/20 0.35
AXL P30530 1/20 0.35
MAPT P10636 2/20 0.34
ACACB O00763 4/20 0.33
HTR2A P28223 1/20 0.33
TP53 P04637 1/20 0.33
CYP2D6 P10635 1/20 0.33

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
SCHEMBL6623481 0.91 MAPT (0.36) CCR3SCN9AMAPTACACBTP53
SCHEMBL6702187 0.87 CCR3 (0.42) CCR3HTR2ACYP2D6
SCHEMBL6622074 0.84 SCN9A (0.37) CCR3SCN9AMAPTACACBTP53
SCHEMBL6620915 0.79 CYP3A4 (0.43) CCR3MAPTACACB
SCHEMBL6623992 0.76 MAPK1 (0.38) MAPT
SCHEMBL5762925 0.75 MAPT (0.36) MAPTTP53
SCHEMBL5761023 0.75 MAPT (0.38) MAPTHTR2ATP53
SCHEMBL5762210 0.74 MAPT (0.35) MAPTTP53
SCHEMBL6620293 0.73 CNR1 (0.49) CCR3MAPT
SCHEMBL5333712 0.72 MAPT (0.36) MAPTACACBHTR2A

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-1487435-A1 AZETIDINE DERIVATIVES AS CCR-3 RECEPTOR ANTAGONISTS Novartis AG (CH) 2004-12-22 EP disclosed
WO-2003077907-A1 AZETIDINE DERIVATIVES AS CCR-3 RECEPTOR ANTAGONISTS NOVARTIS AG (CH) 2003-09-25 WO disclosed