SCHEMBL10089925

SCHEMBL10089925

Cc1cc(Cl)cc(C(=O)NCc2ccc(F)c(F)c2F)c1NC(=O)c1cc(Cn2nnc(C(F)(F)F)n2)nn1-c1ncccc1Cl

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 3/20 0.35
KLKB1 P03952 4/20 0.33
PPARG P37231 1/20 0.32
NTRK1 P04629 7/20 0.32
MAPK8 P45983 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
TP53 P04637 1/20 0.31
RIPK1 Q13546 1/20 0.31

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
SCHEMBL10089896 0.93 P2RX7 (0.38) P2RX7KLKB1PPARGNTRK1MAPK8
SCHEMBL10089873 0.93 MAPK8 (0.36) P2RX7KLKB1NTRK1MAPK8TP53
SCHEMBL10089939 0.93 P2RX7 (0.33) P2RX7KLKB1PPARGNTRK1MAPK8
SCHEMBL10089973 0.92 P2RX7 (0.36) P2RX7TP53
SCHEMBL10089841 0.92 TP53 (0.38) P2RX7MAPK8TP53
SCHEMBL10089948 0.92 TP53 (0.35) P2RX7PPARGNTRK1MAPK8TP53
SCHEMBL10089867 0.91 TP53 (0.33) P2RX7KLKB1NTRK1TRPV1TP53
SCHEMBL10089888 0.91 TP53 (0.34) P2RX7KLKB1TRPV1TP53
SCHEMBL10089883 0.90 P2RX7 (0.36) P2RX7PPARGNTRK1TP53
SCHEMBL10089870 0.90 KMT2A (0.36) KLKB1PPARGNTRK1

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-8791143-B2 Anthranilic diamide derivatives having cyclic side-chains BAYER CROPSCIENCE AG (DE) 2014-07-29 US disclosed
US-20120010249-A1 Anthranilic diamide derivatives having cyclic side-chains BAYER CROPSCIENCE AG (DE) 2012-01-12 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-20120010249-A1 Anthranilic diamide derivatives having cyclic side-chains DDT, ADCY1, ANTXR2 P2RX7 1165/4885KLKB1 4458/4885PPARG 3227/4885

“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.