SCHEMBL3260882

SCHEMBL3260882

Nc1ccccc1C(=O)C1C=CCCC1=O

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.38
GAA P10253 1/20 0.38
CRBN Q96SW2 1/20 0.37
ALDH1A1 P00352 4/20 0.37
HSD17B10 Q99714 3/20 0.37
KDM4E B2RXH2 3/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
CFTR P13569 1/20 0.37
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
FADS1 O60427 1/20 0.34
HSD11B1 P28845 1/20 0.33
MGLL Q99685 1/20 0.33
MCL1 Q07820 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
SCHEMBL2897989 0.78 MCL1 (0.51) MAPTGAAALDH1A1HSD17B10KDM4E
SCHEMBL6575271 0.68 HSD11B1 (0.50) MAPTGAACRBNALDH1A1HSD17B10
SCHEMBL13766474 0.66 MAPT (0.40) MAPTGAACRBNALDH1A1HSD17B10
SCHEMBL1341836 0.65 HDAC3 (0.51) MAPTGAACRBNALDH1A1HSD17B10
SCHEMBL29990240 0.65 HDAC3 (0.51) MAPTGAACRBNALDH1A1HSD17B10
SCHEMBL8880100 0.65 HSD11B1 (0.48) MAPTGAACRBNALDH1A1HSD17B10
SCHEMBL3806095 0.64 MAPT (0.58) MAPTGAAALDH1A1HSD17B10KDM4E
SCHEMBL3920568 0.64 HDAC3 (0.54) MAPTGAAALDH1A1HSD17B10KDM4E
SCHEMBL29953271 0.64 HDAC3 (0.54) MAPTGAAALDH1A1HSD17B10KDM4E
SCHEMBL3908300 0.64 HDAC3 (0.54) MAPTGAAALDH1A1HSD17B10KDM4E

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-7670991-B2 Substituted benzoylcyclohexenones and their use as herbicidal agents BAYER CROPSCIENCE AG (DE) 2010-03-02 US disclosed
US-20040171491-A1 Substituted benzoylcyclohexenones and their use as herbicidal agents BAYER INTELLECTUAL PROPERTY GMBH (DE) 2004-09-02 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-20040171491-A1 Substituted benzoylcyclohexenones and their use as herbicidal agents DDT, CYP1B1, CYP1A1 MAPT 4728/4885GAA 1556/4885CRBN 4083/4885

“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.