SCHEMBL10212436

SCHEMBL10212436

[C-]#[N+]C1=C(C)NC2=C(C1c1ccc3[nH]nc(C)c3c1)S(=O)(=O)CC2

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MET P08581 3/20 0.43
ABCC9 O60706 17/20 0.42
ABCC8 Q09428 17/20 0.42
KCNJ11 Q14654 17/20 0.42
KCNJ8 Q15842 17/20 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
SCHEMBL561467 0.83 ABCC9 (0.62) METABCC9ABCC8KCNJ11KCNJ8
SCHEMBL10212435 0.82 ABCC9 (0.42) METABCC9ABCC8KCNJ11KCNJ8
SCHEMBL10212439 0.80 MET (0.44) METABCC9ABCC8KCNJ11KCNJ8
SCHEMBL10212419 0.78 MET (0.45) METABCC9ABCC8KCNJ11KCNJ8
SCHEMBL10212438 0.78 MET (0.43) METABCC9ABCC8KCNJ11KCNJ8
SCHEMBL10212427 0.77 MET (0.44) METABCC9ABCC8KCNJ11KCNJ8
SCHEMBL9906876 0.75 MET (0.53) MET
SCHEMBL11938832 0.74 MET (0.72) MET
SCHEMBL10212433 0.71 MET (0.44) MET
SCHEMBL11938833 0.71 MET (0.79) MET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8759341-B2 Bi- and tricyclic indazole-substituted 1,4-dihydropyridine derivatives and uses thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-06-24 US disclosed
US-20120035409-A1 BI- AND TRICYCLIC INDAZOLE-SUBSTITUTED 1,4-DIHYDROPYRIDINE DERIVATIVES AND USES THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2012-02-09 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-20120035409-A1 BI- AND TRICYCLIC INDAZOLE-SUBSTITUTED 1,4-DIHYDROPYRIDINE DERIVATIVES AND USES THEREOF MET, RET, ERBB2 MET 1/4885ABCC9 3756/4885ABCC8 3709/4885

“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.