SCHEMBL790164

SCHEMBL790164

CN(C(=O)c1ccc(Oc2ccnc(Cl)n2)nc1)c1cccnc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.46
OXTR P30559 1/20 0.42
MLYCD O95822 1/20 0.39
NOTUM Q6P988 1/20 0.39
KMT2A Q03164 2/20 0.38
MAPT P10636 1/20 0.38
LIPE Q05469 1/20 0.38
HTR2C P28335 1/20 0.38
RAB9A P51151 4/20 0.38
GALR3 O60755 1/20 0.38
MAPK1 P28482 1/20 0.38
KDM4E B2RXH2 2/20 0.38
HSD17B10 Q99714 4/20 0.37
GRM5 P41594 1/20 0.37
MLNR O43193 1/20 0.37
CSF1R P07333 1/20 0.36
HTT P42858 1/20 0.36
NPC1 O15118 3/20 0.36
ALOX15 P16050 1/20 0.36
TNF P01375 1/20 0.36

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
SCHEMBL791302 0.87 OXTR (0.46) TRPV1OXTRMLYCDNOTUMKMT2A
SCHEMBL12978072 0.83 TRPV1 (0.47) TRPV1OXTRMLYCDNOTUMKMT2A
SCHEMBL790776 0.83 LIPE (0.54) TRPV1OXTRKMT2AMAPTLIPE
SCHEMBL790837 0.83 HRH3 (0.48) TRPV1OXTRNOTUMKMT2AMAPT
SCHEMBL790963 0.83 TRPV1 (0.46) TRPV1OXTRMLYCDNOTUMKMT2A
SCHEMBL791150 0.81 OXTR (0.62) TRPV1OXTRMLYCDNOTUMKMT2A
SCHEMBL791062 0.81 HRH3 (0.48) TRPV1OXTRKMT2AMAPTLIPE
SCHEMBL789585 0.81 HRH3 (0.50) TRPV1OXTRKMT2AMAPTLIPE
SCHEMBL790676 0.80 TRPV1 (0.46) TRPV1OXTRMLYCDNOTUMKMT2A
SCHEMBL789610 0.80 GPBAR1 (0.54) TRPV1OXTRNOTUMKMT2AMAPT

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 3 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

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-20130180014-A1 Pyridine Compounds for Controlling Invertebrate Pests III CHRM1, CHRM2, GRIN2C TRPV1 1012/4885OXTR 1398/4885MLYCD 2218/4885

“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.