SCHEMBL12049331

SCHEMBL12049331

CC(=O)N1CCC(COc2ccc3c(C4CCN(C(=O)Nc5ccc(N6CCCC6)cc5)CC4)ncnc3c2)CC1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.47
PDGFRB P09619 8/20 0.46
PDGFRA P16234 2/20 0.44
AURKA O14965 1/20 0.44
CDK1 P06493 1/20 0.44
FLT1 P17948 1/20 0.44
FLT4 P35916 1/20 0.44
CSF1R P07333 1/20 0.43
MAPK7 Q13164 1/20 0.43
MAPT P10636 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL12049213 0.94 KDR (0.54) KDRPDGFRBPDGFRAAURKACDK1
SCHEMBL12049412 0.91 PDGFRB (0.45) KDRPDGFRBPDGFRAAURKACDK1
SCHEMBL12049330 0.89 PDGFRB (0.44) KDRPDGFRBPDGFRACSF1RMAPK7
SCHEMBL12049143 0.88 KDR (0.53) KDRPDGFRBPDGFRAAURKACDK1
SCHEMBL12049878 0.88 IDO1 (0.43) KDRPDGFRBPDGFRAAURKACDK1
SCHEMBL12049335 0.87 NAMPT (0.47) PDGFRBPDGFRACSF1RMAPT
SCHEMBL12049308 0.87 PDGFRB (0.46) KDRPDGFRBPDGFRACSF1RMAPK7
SCHEMBL12049343 0.87 CSF1R (0.44) PDGFRBPDGFRACSF1RMAPK7
SCHEMBL12049344 0.86 PDGFRB (0.48) PDGFRBPDGFRAAURKACSF1RMAPK7
SCHEMBL12049313 0.86 NAMPT (0.47) PDGFRBPDGFRACSF1RMAPK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8071768-B2 Alkylquinoline and alkylquinazoline kinase modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2011-12-06 US disclosed
US-8071768-B2 Alkylquinoline and alkylquinazoline kinase modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2011-12-06 US disclosed
US-20070004660-A1 Synergistic Modulation of Flt3 Kinase Using Alkylquinolines and Alkylquinazolines JANSSEN PHARMACEUTICA, N.V. (BE) 2007-01-04 US disclosed
US-20070004660-A1 Synergistic Modulation of Flt3 Kinase Using Alkylquinolines and Alkylquinazolines JANSSEN PHARMACEUTICA, N.V. (BE) 2007-01-04 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 (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-20070004660-A1 Synergistic Modulation of Flt3 Kinase Using Alkylquinolines and Alkylquinazolines FLT3, MCL1, CDC42BPG KDR 257/4885PDGFRB 224/4885PDGFRA 262/4885

“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.