SCHEMBL12978265

SCHEMBL12978265

CN(C(=O)c1ccc(F)c(C(F)(F)F)c1)c1cccnc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GPBAR1 Q8TDU6 13/20 0.61
▸ TRPV1 Q8NER1 1/20 0.53
▸ POLQ O75417 1/20 0.52
▸ VNN1 O95497 1/20 0.49
▸ MLYCD O95822 1/20 0.48
▸ HDAC8 Q9BY41 1/20 0.46
▸ KDM4E B2RXH2 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ TEK Q02763 1/20 0.43

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
SCHEMBL12977992 0.81 TRPV1 (0.50) GPBAR1TRPV1POLQMLYCDKDM4E
SCHEMBL12978268 0.80 GPBAR1 (0.59) GPBAR1TRPV1POLQVNN1MLYCD
SCHEMBL19245118 0.78 GRIN2B (0.44) GPBAR1TRPV1POLQVNN1MLYCD
SCHEMBL12977968 0.78 TRPV1 (0.55) GPBAR1TRPV1POLQMLYCDHDAC8
SCHEMBL12978272 0.78 TRPV1 (0.55) GPBAR1TRPV1MLYCDKDM4EKMT2A
SCHEMBL6237453 0.77 KDM4E (0.68) TRPV1MLYCDKDM4EKMT2A
SCHEMBL13095766 0.77 TRPV1 (0.56) GPBAR1TRPV1MLYCDKDM4EKMT2A
SCHEMBL12977961 0.77 TRPV1 (0.60) TRPV1POLQMLYCDKDM4EKMT2A
SCHEMBL13095850 0.77 TRPV1 (0.56) TRPV1POLQMLYCDKDM4EKMT2A
SCHEMBL12977958 0.77 TRPV1 (0.54) TRPV1POLQMLYCDKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 (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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR GPBAR1 4037/4885TRPV1 2769/4885POLQ 1550/4885

“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.

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