SCHEMBL515151

SCHEMBL515151

Cc1cc(OCc2ccccc2)cc(C)c1C1=C(OC(=O)C(C)(C)C)C2C3CCC(CC3)C2C1=O

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 11/20 0.41
S1PR1 P21453 1/20 0.38
S1PR5 Q9H228 1/20 0.38
PRKCA P17252 1/20 0.37
PRKCD Q05655 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
MAOA P21397 2/20 0.36
MAOB P27338 2/20 0.36
MRGPRX4 Q96LA9 1/20 0.35
HIF1A Q16665 1/20 0.35
NPC1 O15118 1/20 0.35
CASP3 P42574 1/20 0.35
RAB9A P51151 1/20 0.35
SENP8 Q96LD8 1/20 0.35
SENP7 Q9BQF6 1/20 0.35
SENP6 Q9GZR1 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
BRD4 O60885 1/20 0.34

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
SCHEMBL515606 0.86 FFAR1 (0.41) FFAR1S1PR1S1PR5PRKCAPRKCD
SCHEMBL13261958 0.86 FFAR1 (0.41) FFAR1S1PR1S1PR5PRKCAPRKCD
SCHEMBL16281722 0.86 FFAR1 (0.41) FFAR1S1PR1S1PR5PRKCAPRKCD
SCHEMBL515605 0.86 FFAR1 (0.41) FFAR1S1PR1S1PR5PRKCAPRKCD
SCHEMBL515509 0.82 MAPT (0.33)
SCHEMBL10187572 0.81 FFAR1 (0.42) FFAR1S1PR1S1PR5MEN1KMT2A
SCHEMBL10187570 0.72 FFAR1 (0.43) FFAR1S1PR1S1PR5MEN1KMT2A
SCHEMBL16281728 0.72 FFAR1 (0.43) FFAR1S1PR1S1PR5MEN1KMT2A
SCHEMBL516021 0.71 GRM5 (0.38) PRKCAPRKCDMEN1KMT2AMAOA
SCHEMBL10257841 0.69 MEN1 (0.30) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2393769-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2014-12-10 EP disclosed
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-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
US-20120028800-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-02-02 US disclosed
EP-2393769-A1 NOVEL HERBICIDES Syngenta Limited (GB) 2011-12-14 EP 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 FFAR1 752/4885S1PR1 3494/4885S1PR5 4209/4885

“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.