SCHEMBL7448599

SCHEMBL7448599

N=C(N)NCCC[C@H](N)C(=O)NCCN(CCNC(=O)[C@@H](N)CCCNC(=N)N)CCNC(=O)[C@@H](N)CCCNC(=N)N

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 2/20 0.49
GNAI3 P08754 1/20 0.43
GNAO1 P09471 1/20 0.43
GNAI1 P63096 1/20 0.43
RRM1 P23921 1/20 0.42
NOS1 P29475 2/20 0.39
NPY4R P50391 7/20 0.38
NPY1R P25929 5/20 0.38
NPY2R P49146 4/20 0.38
NPY5R Q15761 4/20 0.38
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
OTC P00480 1/20 0.35
NOD1 Q9Y239 1/20 0.34
ALOX15 P16050 1/20 0.34

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
SCHEMBL7443155 0.89 NPY4R (0.48) DPP7GNAI3GNAO1GNAI1NPY4R
SCHEMBL23610947 0.89 DPP7 (0.61) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL23626315 0.89 DPP7 (0.61) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL12533227 0.88 GNAI3 (0.44) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL30565716 0.88 DPP7 (0.50) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL10060130 0.85 DPP7 (0.43) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL17301799 0.84 DPP7 (0.53) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL7327484 0.84 DPP7 (0.53) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL16627564 0.84 DPP7 (0.47) DPP7GNAI3GNAO1GNAI1RRM1
SCHEMBL19750592 0.83 DPP7 (0.60) DPP7GNAI3GNAO1GNAI1RRM1

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
US-6063819-A PROTECTING NEURONS FROM DAMAGE BY ADMINISTERING TO HUMANS POLYGUADINO COMPOUNDS CYPROS PHARMACEUTICAL CORP. (US) 2000-05-16 US disclosed
WO-1998036743-A1 NEUROPROTECTIVE POLY-GUANIDINO COMPOUNDS WHICH BLOCK PRESYNAPTIC N AND P/Q CALCIUM CHANNELS CYPROS PHARMACEUTICAL CORPORATION (US) 1998-08-27 WO disclosed