SCHEMBL7657641

SCHEMBL7657641

COc1cc2ncnc(N3CCN(C(=C[N+](=O)[O-])NCc4ccncc4)CC3)c2cc1OC

nearest known ligand 0.60

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 20/20 0.60
PDGFRA P16234 17/20 0.60
KIT P10721 1/20 0.59

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
SCHEMBL7657607 0.86 PDGFRB (0.75) PDGFRBPDGFRAKIT
SCHEMBL7657609 0.86 PDGFRB (0.75) PDGFRBPDGFRAKIT
SCHEMBL6791677 0.84 PDGFRB (0.82) PDGFRBPDGFRAKIT
SCHEMBL2923971 0.82 PDGFRB (0.84) PDGFRBPDGFRAKIT
SCHEMBL7657638 0.80 PDGFRB (0.58) PDGFRBPDGFRAKIT
SCHEMBL7664045 0.79 PDGFRB (0.61) PDGFRBPDGFRAKIT
SCHEMBL7662279 0.78 PDGFRB (0.60) PDGFRBPDGFRAKIT
SCHEMBL2918300 0.78 PDGFRB (0.81) PDGFRBPDGFRAKIT
SCHEMBL7662286 0.78 PDGFRB (0.60) PDGFRBPDGFRAKIT
SCHEMBL7656087 0.77 ACHE (0.62) PDGFRBPDGFRAKIT

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-6423716-B1 Nitrogenous heterocyclic compounds KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-07-23 US disclosed
EP-1067123-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-01-10 EP disclosed