SCHEMBL10089907

SCHEMBL10089907

Cc1cc(C#N)cc(C(=O)NCc2cccc(OC(F)(F)F)c2)c1NC(=O)c1cc(Cn2nnc(C(F)(F)F)n2)nn1-c1ccccc1Cl

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 1/20 0.37
PPARG P37231 2/20 0.37
GLS O94925 5/20 0.36
RIPK1 Q13546 5/20 0.36
P2RX7 Q99572 1/20 0.35
CNR1 P21554 3/20 0.35
POLB P06746 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
KLKB1 P03952 1/20 0.35
SLC2A1 P11166 1/20 0.34
SLC2A3 P11169 1/20 0.34
SLC2A4 P14672 1/20 0.34

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
SCHEMBL10089908 0.95 KLKB1 (0.35) ABCB1PPARGCNR1POLBKLKB1
SCHEMBL10089953 0.94 RIPK1 (0.37) ABCB1PPARGGLSRIPK1CNR1
SCHEMBL10089902 0.94 IDH1 (0.37) CNR1KLKB1SLC2A1SLC2A3SLC2A4
SCHEMBL10089879 0.92 CNR1 (0.41) CNR1POLBSLC2A1SLC2A3SLC2A4
SCHEMBL10089878 0.92 IDH1 (0.39) CNR1SLC2A1SLC2A3SLC2A4
SCHEMBL10089941 0.92 RIPK1 (0.37) ABCB1PPARGGLSRIPK1CNR1
SCHEMBL10090022 0.90 IDH1 (0.37) CNR1SLC2A1SLC2A3SLC2A4
SCHEMBL10089857 0.90 LMNA (0.39) CNR1KLKB1SLC2A1SLC2A3SLC2A4
SCHEMBL17122517 0.90 ABCB1 (0.38) ABCB1PPARGGLSRIPK1P2RX7
SCHEMBL10089936 0.90 IDH1 (0.39) CNR1KLKB1SLC2A1SLC2A3SLC2A4

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 ABCB1 3201/4885PPARG 3227/4885GLS 259/4885

“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.