SCHEMBL986192

SCHEMBL986192

Nc1ncc(-c2ccc(NC(=O)CN3CCCC3CO)cc2)cc1-c1nnnn1-c1cccc(F)c1F

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.39
PDGFRB P09619 1/20 0.39
KIT P10721 1/20 0.39
PDGFRA P16234 1/20 0.39
HRH3 Q9Y5N1 1/20 0.37
AURKA O14965 5/20 0.37
AURKB Q96GD4 1/20 0.36
AURKC Q9UQB9 1/20 0.36
MET P08581 2/20 0.35
KCNN4 O15554 2/20 0.34
MAPT P10636 2/20 0.34
NTRK1 P04629 1/20 0.34
NTRK3 Q16288 1/20 0.34
NTRK2 Q16620 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
HBB P68871 1/20 0.34
KMT2A Q03164 1/20 0.34
BAP1 Q92560 1/20 0.34
SLC2A1 P11166 1/20 0.34

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
SCHEMBL986190 1.00 CSF1R (0.39) CSF1RPDGFRBKITPDGFRAHRH3
SCHEMBL985352 0.87 SLC2A1 (0.41) MAPTALDH1A1HTTKMT2ASLC2A1
SCHEMBL4409607 0.86 SPHK1 (0.44)
SCHEMBL986077 0.86 SPHK1 (0.44)
SCHEMBL985133 0.85 KCNN4 (0.41) KCNN4MAPTKMT2A
SCHEMBL984295 0.83 SLC2A1 (0.49) MAPTALDH1A1SLC2A1
SCHEMBL987272 0.81 CYP3A4 (0.42) KCNN4MAPTKMT2A
SCHEMBL982851 0.81 GSK3B (0.43) AURKBKCNN4MAPTALDH1A1KMT2A
SCHEMBL14399155 0.81 KCNN4 (0.37) KCNN4MAPTKMT2A
SCHEMBL984929 0.81 KCNN4 (0.42) KCNN4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101479255-B C-MET protein kinase inhibitors for the treatment of proliferative disorders VERTEX PHARMA 2013-05-01 CN claimed
US-8232406-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2012-07-31 US claimed
US-20110059936-A1 C-MET PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-03-10 US claimed
US-7872031-B2 c-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-01-18 US claimed
EP-2004625-B1 C-MET PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF PROLIFERATIVE DISORDERS VERTEX PHARMA (US) 2009-12-30 EP claimed
US-20070254868-A1 C-MET protein kinase inhibitors VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-11-01 US claimed

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-20110059936-A1 C-MET PROTEIN KINASE INHIBITORS MET, PRKCH, ABL1 CSF1R 724/4885PDGFRB 203/4885KIT 261/4885
US-20070254868-A1 C-MET protein kinase inhibitors MET, PRKCH, ABL1 CSF1R 724/4885PDGFRB 203/4885KIT 261/4885

“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.