SCHEMBL10089966

SCHEMBL10089966

O=C(NCc1cccc(Cl)c1)c1cc2ccccc2c(Cl)c1NC(=O)c1cc(Cn2nnc(C(F)(F)F)n2)nn1-c1ncccc1Cl

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 3/20 0.37
TP53 P04637 1/20 0.37
CNR2 P34972 2/20 0.36
LMNA P02545 2/20 0.35
HPGD P15428 1/20 0.35
POLB P06746 2/20 0.35
MEN1 O00255 1/20 0.34
HCRTR1 O43613 1/20 0.34
KMT2A Q03164 1/20 0.34
CCR1 P32246 2/20 0.33
ROCK1 Q13464 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL10090040 0.94 EGLN1 (0.36) MMP13CNR2LMNA
SCHEMBL10090007 0.92 ABCB1 (0.39) ROCK1
SCHEMBL10089956 0.92 MEN1 (0.38) TP53CNR2LMNAMEN1KMT2A
SCHEMBL10090006 0.90 PTGER4 (0.37) HPGD
SCHEMBL10089924 0.89 MMP13 (0.38) MMP13TP53CNR2LMNAHPGD
SCHEMBL10090043 0.89 MMP13 (0.38) MMP13CNR2LMNAHPGDPOLB
SCHEMBL10090009 0.89 MMP13 (0.38) MMP13TP53CNR2LMNAHPGD
SCHEMBL17122543 0.88 IDH1 (0.33) MMP13
SCHEMBL10089946 0.88 HSD17B13 (0.39)
SCHEMBL10089882 0.87 MMP13 (0.38) MMP13CNR2LMNAHPGDPOLB

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-2582695-B1 ANTHRANILIC ACID DIAMIDE DERIVATIVES WITH CYCLICAL SIDE CHAINS BAYER IP GMBH (DE) 2015-09-30 EP disclosed
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 MMP13 4356/4885TP53 3397/4885CNR2 1011/4885

“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.