SCHEMBL9698355

SCHEMBL9698355

CCCCC(C)(C(N)=O)C1CCCCN1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 7/20 0.36
CCR1 P32246 1/20 0.36
CCR5 P51681 1/20 0.36
CXCR4 P61073 1/20 0.36
PRCP P42785 3/20 0.35
DPP7 Q9UHL4 1/20 0.32
SIGMAR1 Q99720 1/20 0.31
GNAI3 P08754 2/20 0.30
GNAO1 P09471 2/20 0.30
GNAI1 P63096 2/20 0.30
CYP1A2 P05177 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
SCHEMBL1907489 0.86 PRCP (0.34) CCR2PRCPDPP7CYP1A2
SCHEMBL9340449 0.76 CCR2 (0.35) CCR2CCR1CCR5CXCR4PRCP
SCHEMBL21191731 0.76 CYP1A2 (0.36) CCR2CCR1CCR5CXCR4PRCP
SCHEMBL8471413 0.74 CCR2 (0.33) CCR2CYP1A2
SCHEMBL8283621 0.74 CCR2 (0.33) CCR2CYP1A2
SCHEMBL21191705 0.73 CCR2 (0.37) CCR2CCR1CCR5CXCR4PRCP
SCHEMBL22023884 0.73 CYP1A2 (0.34) CCR2CCR1CCR5CXCR4CYP1A2
SCHEMBL26653572 0.73 CYP1A2 (0.34) CCR2CCR1CCR5CXCR4CYP1A2
Hydrochloric Acid SCHEMBL9698143 0.73 KDM4E (0.34) CCR2CYP1A2
SCHEMBL23634135 0.71 CCR2 (0.38) CCR2CCR1CCR5CXCR4PRCP

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-1992003415-A1 PROTEIN KINASE C MODULATORS NOVA PHARMACEUTICAL CORPORATION (US) 1992-03-05 WO disclosed