SCHEMBL790794

SCHEMBL790794

CN(C(=O)c1cnc(Oc2ccc(C(F)(F)F)cc2)c(Cl)c1)c1cccnc1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LIPE Q05469 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.48
KMT2A Q03164 1/20 0.47
ATM Q13315 1/20 0.47
GPBAR1 Q8TDU6 7/20 0.46
POLQ O75417 1/20 0.46
LMNA P02545 1/20 0.46
MLYCD O95822 1/20 0.45
TLR7 Q9NYK1 1/20 0.43
FFAR1 O14842 1/20 0.42
RAB9A P51151 1/20 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
SCHEMBL789940 0.90 LIPE (0.50) LIPESMN1; SMN2KMT2AATMGPBAR1
SCHEMBL790175 0.89 LIPE (0.53) LIPESMN1; SMN2KMT2AGPBAR1LMNA
SCHEMBL790218 0.88 LIPE (0.50) LIPESMN1; SMN2KMT2AATMGPBAR1
SCHEMBL789627 0.84 LIPE (0.47) LIPEGPBAR1RAB9A
SCHEMBL12978097 0.84 LIPE (0.47) LIPESMN1; SMN2KMT2AGPBAR1LMNA
SCHEMBL790846 0.83 ALDH1A1 (0.46) LIPESMN1; SMN2KMT2AATMLMNA
SCHEMBL791001 0.83 RAB9A (0.58) LIPEPOLQLMNAMLYCDRAB9A
SCHEMBL12978080 0.82 RAB9A (0.57) LIPEPOLQLMNAMLYCDRAB9A
SCHEMBL791303 0.78 HTT (0.45) LIPESMN1; SMN2KMT2AATMLMNA
SCHEMBL15093132 0.78 EPHX2 (0.58) SMN1; SMN2KMT2AATMRAB9A

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 LIPE 4781/4885SMN1; SMN2 1928/4885KMT2A 1030/4885
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR LIPE 3068/4885SMN1; SMN2 2519/4885KMT2A 412/4885

“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.