SCHEMBL7704804

SCHEMBL7704804

CCCCCCCCCCCCC(=O)N(CCCCCCN)C(=O)[C@@H]1CCCN1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.45
TLR2 O60603 2/20 0.37
DPP7 Q9UHL4 1/20 0.36
GNAI3 P08754 1/20 0.35
GNAO1 P09471 1/20 0.35
GNAI1 P63096 1/20 0.35
SCN4A P35499 1/20 0.33
KDM5A P29375 3/20 0.33
PHF8 Q9UPP1 3/20 0.33
KDM4C Q9H3R0 2/20 0.33
NAAA Q02083 2/20 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
SCHEMBL7704744 0.96 PRCP (0.41) PRCPTLR2DPP7GNAI3GNAO1
SCHEMBL7704766 0.82 PRCP (0.38) PRCPTLR2DPP7GNAI3GNAO1
SCHEMBL7707952 0.81 SIGMAR1 (0.42) KDM5APHF8KDM4CNAAA
SCHEMBL7707925 0.81 SIGMAR1 (0.42) KDM5APHF8KDM4CNAAA
SCHEMBL29289470 0.77 DNM1 (0.48) KDM5APHF8KDM4C
Hydrochloric Acid SCHEMBL9439145 0.74 PRCP (0.52) PRCPTLR2DPP7GNAI3GNAO1
SCHEMBL7710604 0.73 TLR2 (0.30) TLR2
SCHEMBL15741396 0.72 PRCP (0.46) PRCPTLR2DPP7GNAI3GNAO1
Hydrochloric Acid SCHEMBL28887821 0.72 DNM1 (0.45) KDM5APHF8KDM4C
SCHEMBL15970512 0.72 PRCP (0.60) PRCPTLR2DPP7GNAI3GNAO1

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-1263730-A1 AMINE DERIVATIVES FOR THE TREATMENT OF APOPTOSIS Applied Research Systems ARS Holding N.V. (AN) 2002-12-11 EP claimed
WO-2001060798-A1 AMINE DERIVATIVES FOR THE TREATMENT OF APOPTOSIS APPLIED RESEARCH SYSTEMS ARS HOLDING N.V. (AN) 2001-08-23 WO claimed