SCHEMBL789917

SCHEMBL789917

CN(C(=O)c1ccc(Sc2ccc(Cl)cc2)nc1)c1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BRAF P15056 2/20 0.47
KDR P35968 2/20 0.47
TRPV1 Q8NER1 1/20 0.47
NAMPT P43490 2/20 0.41
MLYCD O95822 1/20 0.41
GRM5 P41594 1/20 0.40
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TRPV4 Q9HBA0 1/20 0.39
CYP11B1 P15538 1/20 0.39
CYP11B2 P19099 1/20 0.39
HSD17B10 Q99714 1/20 0.38
NOTUM Q6P988 1/20 0.38
GRM1 Q13255 1/20 0.38
ALOX15 P16050 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL789921 0.91 TRPV1 (0.47) BRAFKDRTRPV1NAMPTMLYCD
SCHEMBL791214 0.88 RAB9A (0.48) TRPV1KDM4EKMT2AALDH1A1HSD17B10
SCHEMBL790174 0.87 MLYCD (0.50) BRAFKDRTRPV1MLYCD
SCHEMBL791260 0.86 TRPV1 (0.43) TRPV1KDM4EKMT2AALDH1A1CYP11B1
SCHEMBL789613 0.86 HTT (0.54) BRAFKDRTRPV1NAMPTGRM5
SCHEMBL12978090 0.85 TRPV1 (0.50) TRPV1MLYCDKDM4EKMT2AALDH1A1
SCHEMBL789948 0.83 TRPV1 (0.53) TRPV1MLYCDKDM4EKMT2AALDH1A1
SCHEMBL789923 0.82 TRPV1 (0.46) KDRTRPV1MLYCDKDM4EKMT2A
SCHEMBL790737 0.80 TRPV1 (0.55) TRPV1MLYCDGRM5KDM4EKMT2A
SCHEMBL12978092 0.80 TRPV1 (0.48) TRPV1MLYCDKDM4EKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2615917-A2 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS III BASF SE (DE) 2013-07-24 EP disclosed
US-20130180014-A1 Pyridine Compounds for Controlling Invertebrate Pests III BASF SE (DE) 2013-07-11 US disclosed
WO-2012034959-A2 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS III BASF SE (DE) 2012-03-22 WO disclosed
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 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 (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-20130180014-A1 Pyridine Compounds for Controlling Invertebrate Pests III CHRM1, CHRM2, GRIN2C BRAF 3567/4885KDR 3586/4885TRPV1 1012/4885
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR BRAF 4392/4885KDR 4617/4885TRPV1 2769/4885

“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.