SCHEMBL985508

SCHEMBL985508

NN=C(Nc1cccc(F)c1F)c1cccnc1N

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 2/20 0.39
NAPRT Q6XQN6 1/20 0.39
TP53 P04637 1/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 1/20 0.39
SHMT2 P34897 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
KDM4E B2RXH2 1/20 0.37
POLB P06746 2/20 0.33
ALDH1A1 P00352 2/20 0.33
SLC40A1 Q9NP59 1/20 0.33
PIK3CD O00329 1/20 0.33
PIK3CA P42336 1/20 0.33
PIK3CB P42338 1/20 0.33
PIK3CG P48736 1/20 0.33
VCP P55072 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL985507 1.00 PRKCI (0.39) PRKCINAPRTTP53MAPTHTT
SCHEMBL982682 0.87 PABPC1 (0.40) PRKCINAPRTMAPTHTTSHMT2
SCHEMBL11946796 0.87 PABPC1 (0.40) PRKCINAPRTMAPTHTTSHMT2
SCHEMBL982681 0.87 PABPC1 (0.40) PRKCINAPRTMAPTHTTSHMT2
SCHEMBL14399255 0.86 TP53 (0.37) PRKCINAPRTTP53MAPTHTT
SCHEMBL984245 0.83 PIK3CD (0.38) PRKCITP53L3MBTL1KDM4EPOLB
SCHEMBL984244 0.83 PIK3CD (0.38) PRKCITP53L3MBTL1KDM4EPOLB
SCHEMBL11946795 0.83 PIK3CD (0.38) PRKCITP53L3MBTL1KDM4EPOLB
SCHEMBL985872 0.81 PRKCI (0.57) PRKCINAPRTTP53MAPTHTT
SCHEMBL4831450 0.79 BRAF (0.44) TP53L3MBTL1KDM4E

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-8232406-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-31 US disclosed
US-7872031-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-01-18 US disclosed
EP-2004625-B1 C-MET PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS VERTEX PHARMA (US) 2009-12-30 EP disclosed
US-20070254868-A1 C-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-11-01 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-20070254868-A1 C-MET protein kinase inhibitors MET, PRKCH, ABL1 PRKCI 4/4885NAPRT 4625/4885TP53 424/4885

“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.