SCHEMBL3260876

SCHEMBL3260876

Nc1ccccc1C(=O)C1=CCCCC1=O

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.46
GAA P10253 1/20 0.46
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
HSD17B10 Q99714 4/20 0.39
TP53 P04637 1/20 0.39
ALOX15 P16050 1/20 0.39
ALDH1A1 P00352 5/20 0.38
CFTR P13569 1/20 0.38
KDM4E B2RXH2 5/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA9 Q16790 1/20 0.36
CRBN Q96SW2 1/20 0.35
POLB P06746 1/20 0.35
TSHR P16473 1/20 0.35
ESRRA P11474 1/20 0.35
RECQL P46063 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
SCHEMBL2897987 0.77 ALDH1A1 (0.45) MAPTGAANPC1RAB9AL3MBTL1
SCHEMBL112507 0.71 MAPT (0.74) MAPTGAANPC1RAB9AL3MBTL1
SCHEMBL30790667 0.71 MAPT (0.74) MAPTGAANPC1RAB9AL3MBTL1
SCHEMBL11883308 0.70 HIF1A (0.37) MAPTTP53ALOX15ALDH1A1KDM4E
SCHEMBL8764887 0.69 MAPT (0.71) MAPTGAANPC1RAB9AL3MBTL1
Ammonia Solution, Strong SCHEMBL10992665 0.69 MAPT (0.71) MAPTGAANPC1RAB9AL3MBTL1
Hydrochloric Acid SCHEMBL11745887 0.69 MAPT (0.71) MAPTGAANPC1RAB9AL3MBTL1
SCHEMBL747380 0.68 HIF1A (0.38) MAPTRAB9ATP53ALOX15ALDH1A1
SCHEMBL6068282 0.68 CNR2 (0.51) MAPTGAARAB9AALDH1A1KDM4E
SCHEMBL444989 0.68 ALDH1A1 (0.47) MAPTGAANPC1RAB9AL3MBTL1

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 1556/4885NPC1 4464/4885

“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.