SCHEMBL790963

SCHEMBL790963

CN(C(=O)c1ccc(Oc2cc(Cl)cc(Cl)c2)nc1)c1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.46
LIPE Q05469 2/20 0.45
MAPT P10636 2/20 0.45
KMT2A Q03164 1/20 0.45
OXTR P30559 1/20 0.42
RAB9A P51151 2/20 0.42
GALR3 O60755 1/20 0.42
MAPK1 P28482 1/20 0.42
HRH3 Q9Y5N1 1/20 0.40
MLNR O43193 2/20 0.40
NPC1 O15118 1/20 0.40
TNF P01375 1/20 0.40
NOD1 Q9Y239 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
GPBAR1 Q8TDU6 1/20 0.40
MLYCD O95822 1/20 0.39
NOTUM Q6P988 1/20 0.39
GRM5 P41594 1/20 0.39
CSF1R P07333 1/20 0.38
HTR2C P28335 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
SCHEMBL789585 0.92 HRH3 (0.50) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL790776 0.90 LIPE (0.54) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL791261 0.88 TRPV1 (0.47) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL791062 0.87 HRH3 (0.48) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL789288 0.86 HTT (0.52) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL789609 0.84 HSD17B1 (0.52) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL790834 0.84 HSD17B1 (0.52) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL790891 0.84 HPGD (0.47) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL789610 0.84 GPBAR1 (0.54) TRPV1LIPEMAPTKMT2AOXTR
SCHEMBL790967 0.84 RAB9A (0.52) TRPV1LIPERAB9AGALR3MAPK1

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 TRPV1 1012/4885LIPE 4781/4885MAPT 1987/4885
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR TRPV1 2769/4885LIPE 3068/4885MAPT 3480/4885

“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.