SCHEMBL789936

SCHEMBL789936

CN(C(=O)c1cnc(Sc2ncccn2)c(Cl)c1)c1cccnc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 1/20 0.47
CSF1R P07333 1/20 0.39
KDM4E B2RXH2 3/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MLYCD O95822 1/20 0.38
NOTUM Q6P988 1/20 0.38
GRM5 P41594 1/20 0.38
GPBAR1 Q8TDU6 3/20 0.38
HSD17B10 Q99714 5/20 0.36
POLB P06746 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
PYGL P06737 1/20 0.36
TSHR P16473 1/20 0.35
POLQ O75417 1/20 0.35

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
SCHEMBL12978140 0.90 TRPV1 (0.43) TRPV1CSF1RKDM4EKMT2ASMN1; SMN2
SCHEMBL12978098 0.89 TRPV1 (0.44) TRPV1CSF1RKDM4EKMT2ASMN1; SMN2
SCHEMBL12978139 0.88 TRPV1 (0.46) TRPV1CSF1RKDM4EKMT2ASMN1; SMN2
SCHEMBL12978090 0.80 TRPV1 (0.50) TRPV1KDM4EKMT2AMLYCDNOTUM
SCHEMBL789593 0.78 HTT (0.45) TRPV1KMT2ASMN1; SMN2GRM5TSHR
SCHEMBL15093566 0.77 HTT (0.47) TRPV1KMT2ASMN1; SMN2NOTUMGRM5
SCHEMBL15093439 0.77 HTT (0.46) TRPV1KMT2ASMN1; SMN2NOTUMGPBAR1
SCHEMBL790175 0.76 LIPE (0.53) TRPV1KDM4EKMT2ASMN1; SMN2NOTUM
SCHEMBL790737 0.75 TRPV1 (0.55) TRPV1KDM4EKMT2ASMN1; SMN2MLYCD
SCHEMBL789917 0.73 BRAF (0.47) TRPV1KDM4EKMT2AMLYCDNOTUM

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 1012/4885CSF1R 4222/4885KDM4E 3161/4885

“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.