SCHEMBL7666331

SCHEMBL7666331

Cn1ncc2c(N3CCN(C(=S)NCc4ccccc4)CC3)ncnc21

nearest known ligand 0.63

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 14/20 0.63
PDGFRA P16234 3/20 0.61
KIT P10721 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.60
NSD2 O96028 1/20 0.54
PKM P14618 1/20 0.54
TP53 P04637 1/20 0.53
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
HTT P42858 1/20 0.52

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
SCHEMBL7656170 0.90 PDGFRB (0.65) PDGFRBPDGFRAKITSMN1; SMN2NSD2
SCHEMBL2912785 0.82 PDGFRB (0.78) PDGFRBPDGFRAKITMEN1KMT2A
Hydrochloric Acid SCHEMBL7655675 0.80 PDGFRB (0.61) PDGFRBPDGFRASMN1; SMN2TP53MEN1
SCHEMBL7656072 0.79 PDGFRB (0.67) PDGFRBPDGFRAKITMEN1KMT2A
SCHEMBL2922247 0.78 PDGFRB (0.78) PDGFRBPDGFRAKIT
SCHEMBL2922962 0.78 PDGFRB (0.74) PDGFRBPDGFRAKIT
SCHEMBL2923018 0.77 PDGFRB (1.00) PDGFRBPDGFRAKIT
SCHEMBL2920825 0.76 PDGFRB (0.79) PDGFRBPDGFRAKIT
SCHEMBL2919724 0.76 PDGFRB (1.00) PDGFRBPDGFRAKIT
SCHEMBL2923993 0.76 PDGFRB (1.00) PDGFRBPDGFRAKITMEN1KMT2A

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