SCHEMBL6700735

SCHEMBL6700735

COCCOc1cc2c(N3CCN(C(=O)OC(C)(C)C)CC3)ncnc2cc1OCCC1CCCCN1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 17/20 0.53
KDM1A O60341 3/20 0.51
CSF1R P07333 1/20 0.47
KIT P10721 1/20 0.47
FLT3 P36888 1/20 0.47

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
SCHEMBL6950156 0.84 KDM1A (0.57) PDGFRBKDM1AKIT
SCHEMBL6700740 0.83 KDM1A (0.48) PDGFRBKDM1AKIT
SCHEMBL6704570 0.82 PDGFRB (0.79) PDGFRBKITFLT3
SCHEMBL6704362 0.82 PDGFRB (0.79) PDGFRBKITFLT3
SCHEMBL6703372 0.80 PDGFRB (0.80) PDGFRBKITFLT3
SCHEMBL6705074 0.79 PDGFRB (0.63) PDGFRBKITFLT3
SCHEMBL1132496 0.78 ENPP1 (0.58) PDGFRBKDM1AKIT
SCHEMBL7154861 0.78 TLR9 (0.56) KDM1AKIT
SCHEMBL906230 0.77 PDE3A (0.49) PDGFRB
SCHEMBL13330552 0.77 PDGFRB (0.65) PDGFRBCSF1RKITFLT3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040259881-A1 Nitrogenous heterocyclic compounds KYOWA HAKKO KOGYO CO, LTD. (JP) 2004-12-23 US disclosed
EP-1309567-A2 NITROGENOUS HETEROCYCLIC COMPOUNDS Millennium Pharmaceuticals, Inc. (US) 2003-05-14 EP disclosed
WO-2002016360-A2 NITROGENOUS HETEROCYCLIC COMPOUNDS COR THERAPEUTICS, INC. (US) 2002-02-28 WO 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 (1 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-20040259881-A1 Nitrogenous heterocyclic compounds WNK2, CDK5, PDGFRA PDGFRB 5/4885KDM1A 4148/4885CSF1R 985/4885

“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.