SCHEMBL7704744

SCHEMBL7704744

CCCCCCCCCCCCC(=O)N(CCCCCCN)C(=O)[C@H]1CCCCN1

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PRCP P42785 3/20 0.41
CCR2 P41597 1/20 0.36
NAAA Q02083 2/20 0.35
GNAI3 P08754 1/20 0.34
GNAO1 P09471 1/20 0.34
GNAI1 P63096 1/20 0.34
TLR2 O60603 2/20 0.34
DPP7 Q9UHL4 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
SCHEMBL7704804 0.96 PRCP (0.45) PRCPNAAAGNAI3GNAO1GNAI1
SCHEMBL7704766 0.86 PRCP (0.38) PRCPCCR2NAAAGNAI3GNAO1
SCHEMBL7707925 0.85 SIGMAR1 (0.42) NAAA
SCHEMBL7707952 0.85 SIGMAR1 (0.42) NAAA
SCHEMBL7707500 0.77 TLR2 (0.30) TLR2
SCHEMBL7710604 0.77 TLR2 (0.30) TLR2
SCHEMBL29289470 0.76 DNM1 (0.48)
SCHEMBL7704806 0.74 CTSC (0.44)
SCHEMBL7707901 0.74 CTSC (0.44)
SCHEMBL7702120 0.74 CTSC (0.44)

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