SCHEMBL4316962

SCHEMBL4316962

CN(C)c1ccc(C=Cc2n[nH]c3ccccc23)c(N)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.47
FGFR1 P11362 4/20 0.47
NTRK1 P04629 3/20 0.41
NTRK3 Q16288 3/20 0.41
NTRK2 Q16620 3/20 0.41
PDPK1 O15530 2/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP3A4 P08684 1/20 0.40
GAA P10253 1/20 0.40
CHEK1 O14757 6/20 0.38
CDK2 P24941 2/20 0.37
CDK4 P11802 2/20 0.37
CDK1 P06493 1/20 0.37
CCNA2 P20248 1/20 0.37
CCND1 P24385 1/20 0.37
CCND3 P30281 1/20 0.37
AURKA O14965 2/20 0.37
AURKB Q96GD4 2/20 0.37
ROCK2 O75116 2/20 0.36
MAP4K4 O95819 2/20 0.36

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
SCHEMBL4316960 1.00 KDR (0.47) KDRFGFR1NTRK1NTRK3NTRK2
SCHEMBL4322650 0.81 KDM4E (0.42) KDRFGFR1NTRK1NTRK3NTRK2
SCHEMBL4322654 0.81 KDM4E (0.42) KDRFGFR1NTRK1NTRK3NTRK2
SCHEMBL4320481 0.80 PTGS2 (0.52) KDRFGFR1AURKAAURKB
SCHEMBL4320483 0.80 PTGS2 (0.52) KDRFGFR1AURKAAURKB
SCHEMBL4319809 0.80 PDPK1 (0.50) KDRFGFR1NTRK1NTRK3NTRK2
SCHEMBL4319805 0.80 PDPK1 (0.50) KDRFGFR1NTRK1NTRK3NTRK2
SCHEMBL4311295 0.78 PDPK1 (0.40) KDRFGFR1NTRK1NTRK3NTRK2
SCHEMBL4311293 0.78 PDPK1 (0.40) KDRFGFR1NTRK1NTRK3NTRK2
SCHEMBL4309455 0.77 KDR (0.49) KDRFGFR1NTRK1NTRK3NTRK2

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-7605272-B2 IGF-1R inhibitor KYOWA HAKKO KIRIN CO., LTD. (JP) 2009-10-20 US disclosed
US-20090054508-A1 IGF-1R INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-02-26 US disclosed
EP-1847532-A1 IGF-1R INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-10-24 EP 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-20090054508-A1 IGF-1R INHIBITOR IGF1R, IGFBP5, IGFBP1 KDR 75/4885FGFR1 18/4885NTRK1 220/4885

“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.