SCHEMBL6711340

SCHEMBL6711340

COc1cc2c(N3CCN(C(=S)NCc4cccnc4)CC3)ncnc2cc1OCCCN1CCCCC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 20/20 1.00
PDGFRA P16234 2/20 0.81

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
SCHEMBL12260196 0.96 PDGFRB (1.00) PDGFRBPDGFRA
SCHEMBL1132841 0.93 PDGFRB (0.87) PDGFRBPDGFRA
SCHEMBL12260204 0.91 PDGFRB (1.00) PDGFRB
SCHEMBL2921329 0.90 PDGFRB (1.00) PDGFRBPDGFRA
Hydrochloric Acid SCHEMBL2923894 0.88 PDGFRB (0.93) PDGFRBPDGFRA
SCHEMBL2917932 0.88 PDGFRB (0.92) PDGFRBPDGFRA
SCHEMBL2920599 0.88 PDGFRB (0.92) PDGFRBPDGFRA
SCHEMBL12260205 0.87 PDGFRB (1.00) PDGFRB
SCHEMBL14293837 0.87 PDGFRB (0.83) PDGFRB
SCHEMBL12260203 0.86 PDGFRB (1.00) PDGFRB

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8022071-B2 Nitrogenous heterocyclic compounds MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-20 US disclosed
US-8022071-B2 Nitrogenous heterocyclic compounds MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-20 US disclosed
US-20090176780-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-07-09 US disclosed
US-20090176780-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS MILLENNIUM PHARMACEUTICALS, INC. (US) 2009-07-09 US disclosed
US-7329655-B2 Nitrogenous heterocyclic compounds MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-02-12 US disclosed
US-7329655-B2 Nitrogenous heterocyclic compounds MILLENNIUM PHARMACEUTICALS, INC. (US) 2008-02-12 US disclosed
US-20040176594-A1 Nitrogenous heterocyclic compounds MILLENNIUM PHARMACEUTICALS, INC. 2004-09-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040176594-A1 Nitrogenous heterocyclic compounds WNK2, NPR1, NPR3 PDGFRB 9/4885PDGFRA 16/4885
US-20090176780-A1 NITROGENOUS HETEROCYCLIC COMPOUNDS WNK2, CDK5, WNK1 PDGFRB 6/4885PDGFRA 4/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.