SCHEMBL13710191

SCHEMBL13710191

Cc1ccc(-c2nc(C3=C(O)CC(C)(C)CC3=O)c(C)s2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PIK3CG P48736 1/20 0.41
RARA P10276 3/20 0.40
RARB P10826 3/20 0.40
RARG P13631 3/20 0.40
WRN Q14191 3/20 0.39
LMNA P02545 2/20 0.39
ALDH1A1 P00352 3/20 0.37
KDM4E B2RXH2 2/20 0.37
GAA P10253 1/20 0.37
RAB9A P51151 1/20 0.37
MAPT P10636 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
MEN1 O00255 1/20 0.37
HTT P42858 1/20 0.37
KMT2A Q03164 1/20 0.37
KDM4C Q9H3R0 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL13710236 0.91 WRN (0.47) PIK3CDPIK3CAPIK3CBPIK3CGRARA
SCHEMBL13710209 0.90 RARA (0.48) PIK3CDPIK3CAPIK3CBPIK3CGRARA
SCHEMBL13710198 0.88 WRN (0.49) PIK3CDPIK3CAPIK3CBPIK3CGRARA
SCHEMBL13710172 0.82 KMT2A (0.44) WRNLMNAALDH1A1KDM4ERAB9A
SCHEMBL13761061 0.81 RARA (0.39) RARARARBRARGALDH1A1KDM4E
SCHEMBL13710221 0.75 APEX1 (0.44) RARARARBRARGLMNAALDH1A1
SCHEMBL13710187 0.75 RARA (0.42) RARARARBRARGWRNALDH1A1
SCHEMBL13710176 0.74 PTGDR2 (0.47) WRNALDH1A1KDM4EGAARAB9A
SCHEMBL13710195 0.74 RARA (0.49) RARARARBRARGALDH1A1KDM4E
SCHEMBL14506986 0.74 RARA (0.46) PIK3CDPIK3CAPIK3CBPIK3CGRARA

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-7595404-B2 Thiazolyl-substituted carbocyclic 1,3-diones as pesticidal agents BAYER CROPSCIENCE AG (DE) 2009-09-29 US disclosed
US-7595404-B2 Thiazolyl-substituted carbocyclic 1,3-diones as pesticidal agents BAYER CROPSCIENCE AG (DE) 2009-09-29 US disclosed
US-20070135630-A1 Thiazolyl-substsituted carbocylic 1,3-diones as pesticidal agents BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-06-14 US disclosed
US-20070135630-A1 Thiazolyl-substsituted carbocylic 1,3-diones as pesticidal agents BAYER INTELLECTUAL PROPERTY GMBH (DE) 2007-06-14 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-20070135630-A1 Thiazolyl-substsituted carbocylic 1,3-diones as pesticidal agents DDT, CYP4B1, CYP1B1 PIK3CD 565/4885PIK3CA 1251/4885PIK3CB 992/4885

“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.