SCHEMBL397631

SCHEMBL397631

CN(c1ccccc1)S(=O)(=O)Cc1ccc2ccc3ncc(Cl)cc3c(=O)c2c1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MET P08581 20/20 0.52
MST1R Q04912 2/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C9 P11712 1/20 0.42
FECH P22830 1/20 0.42
KCNH2 Q12809 1/20 0.41

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
SCHEMBL399405 0.87 MET (0.65) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL398498 0.81 MET (0.80) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL10176090 0.80 MET (0.58) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL2450541 0.77 MET (0.55) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL4396025 0.77 MET (0.48) METMST1RKCNH2
SCHEMBL397663 0.76 MET (0.52) METMST1RKCNH2
SCHEMBL400231 0.74 MET (0.68) METMST1RCYP3A4CYP2D6CYP2C9
SCHEMBL10176115 0.74 MET (0.47) METMST1RKCNH2
SCHEMBL2446446 0.73 MET (0.70) METMST1RCYP3A4CYP2C9FECH
SCHEMBL4297592 0.73 MET (0.58) METMST1RKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049494-B1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME (US) 2014-06-25 EP disclosed
EP-2049494-B1 TYROSINE KINASE INHIBITORS MERCK SHARP & DOHME (US) 2014-06-25 EP disclosed
US-8222269-B2 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2012-07-17 US disclosed
US-8222269-B2 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2012-07-17 US disclosed
US-8222269-B2 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2012-07-17 US disclosed
US-8101603-B2 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2012-01-24 US disclosed
US-8101603-B2 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2012-01-24 US disclosed
US-8101603-B2 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. (US) 2012-01-24 US disclosed
US-20090203684-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2009-08-13 US disclosed
US-20090203684-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2009-08-13 US disclosed
US-20090203684-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2009-08-13 US disclosed
US-20090012076-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2009-01-08 US disclosed
US-20090012076-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2009-01-08 US disclosed
US-20090012076-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME LLC 2009-01-08 US disclosed
WO-2008008310-A2 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2008-01-17 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 (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-20090012076-A1 Tyrosine kinase inhibitors ABL1, ERBB2, MET MET 3/4885MST1R 181/4885CYP3A4 3774/4885
US-20090203684-A1 Tyrosine kinase inhibitors ABL1, MET, ERBB2 MET 2/4885MST1R 204/4885CYP3A4 3658/4885

“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.