SCHEMBL10187585

SCHEMBL10187585

COC1=C(c2c(C)cc(OCc3ccccc3)cc2C)C(=O)/C(=C/C2CCOCC2)C1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ACHE P22303 11/20 0.40
BACE1 P56817 2/20 0.40
FFAR1 O14842 3/20 0.39
NPC1 O15118 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
NFKB1 P19838 1/20 0.36
MAOB P27338 1/20 0.36
GRM5 P41594 1/20 0.36
RAB9A P51151 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL515251 1.00 ACHE (0.40) ACHEBACE1FFAR1NPC1ALDH1A1
SCHEMBL10239404 0.78 FFAR1 (0.37) FFAR1NPC1ALDH1A1HPGDNFKB1
SCHEMBL515849 0.72 MAOB (0.44) FFAR1NPC1ALDH1A1HPGDNFKB1
SCHEMBL12239392 0.68 ELANE (0.35)
SCHEMBL15001097 0.65 EZH2 (0.31)
SCHEMBL10187572 0.64 FFAR1 (0.42) FFAR1NPC1ALDH1A1HPGDNFKB1
SCHEMBL10192897 0.62 BRD4 (0.51) FFAR1MAOB
SCHEMBL10187570 0.62 FFAR1 (0.43) FFAR1MAOB
SCHEMBL16281728 0.62 FFAR1 (0.43) FFAR1MAOB
SCHEMBL29092271 0.61 MAOB (0.57) ACHEBACE1NPC1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2393769-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-12-10 EP disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-8680339-B2 Herbicides SYNGENTA LIMITED (GB) 2014-03-25 US disclosed
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 US disclosed
WO-2010089210-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-08-12 WO 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-20120028800-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ACHE 11/4885BACE1 1901/4885FFAR1 752/4885

“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.