SCHEMBL9828167

SCHEMBL9828167

NC(=NCCCc1c[nH]cn1)NCCN(c1ccccc1)c1ccccn1

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 1/20 0.39

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
SCHEMBL9827731 0.93 NPY1R (0.40) NPY1R
Hydrochloric Acid SCHEMBL10372618 0.92 HRH4 (0.36) NPY1R
SCHEMBL9828331 0.91 MTNR1A (0.38) NPY1R
SCHEMBL9829117 0.86 KCNH2 (0.41) NPY1R
SCHEMBL9828418 0.85 SSTR4 (0.42) NPY1R
Hydrochloric Acid SCHEMBL10370666 0.85 NPY1R (0.36) NPY1R
SCHEMBL9827938 0.82 CYP2D6 (0.45)
Hydrochloric Acid SCHEMBL10371446 0.82 HRH4 (0.40)
SCHEMBL9771136 0.81 HRH4 (0.37)
SCHEMBL7287548 0.81 HRH2 (0.47) NPY1R

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
EP-0302896-B1 N-(W-SUBSTITUTED ALKYL)-N'-[(IMIDAZOLE-4-YL)ALKYL]GUANIDINE CEDONA PHARMACEUTICALS B.V. (NL) 1991-08-14 EP claimed