SCHEMBL13097072

SCHEMBL13097072

Cc1ccc(-n2cc(Cl)cn2)cc1C1=C(O)C(C)(C)SC1=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RIPK2 O43353 14/20 0.33
MAP4K4 O95819 1/20 0.31
CYP3A4 P08684 1/20 0.31
ACACB O00763 1/20 0.31
ACACA Q13085 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ELANE P08246 1/20 0.30

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
SCHEMBL12129152 0.81 ALDH1A1 (0.32) RIPK2MAP4K4CYP3A4ACACBACACA
SCHEMBL13097293 0.78 MEN1 (0.38) RIPK2MEN1KMT2A
SCHEMBL13097277 0.76 RIPK2 (0.33) RIPK2ACACBACACA
SCHEMBL13097119 0.76 NPY5R (0.32) RIPK2ACACBACACAELANE
SCHEMBL13097065 0.75 ACACB (0.48) RIPK2ACACBACACAKMT2A
SCHEMBL13097068 0.71 MAPT (0.32) RIPK2MAP4K4CYP3A4MEN1KMT2A
SCHEMBL11486255 0.69 NPC1 (0.43) CYP3A4MEN1KMT2A
SCHEMBL11489095 0.67 GRM4 (0.36) MAP4K4CYP3A4MEN1KMT2AELANE
SCHEMBL13097113 0.67 RIPK2 (0.35) RIPK2ACACBACACA
SCHEMBL13097093 0.66 EGLN1 (0.31) ACACBACACA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100267964-A1 N-HETEROCYCLYLPHENYL-SUBSTITUTED CYCLIC KETOENOLS FISCHER REINER 2010-10-21 US disclosed
US-20100267964-A1 N-HETEROCYCLYLPHENYL-SUBSTITUTED CYCLIC KETOENOLS FISCHER REINER 2010-10-21 US disclosed
US-7776791-B2 N-heterocyclyl phenyl-substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2010-08-17 US disclosed
US-7776791-B2 N-heterocyclyl phenyl-substituted cyclic ketoenols BAYER CROPSCIENCE AG (DE) 2010-08-17 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-20100267964-A1 N-HETEROCYCLYLPHENYL-SUBSTITUTED CYCLIC KETOENOLS CYP17A1, CCNY, CCNE2 RIPK2 3998/4885MAP4K4 714/4885CYP3A4 192/4885

“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.