SCHEMBL10326776

SCHEMBL10326776

Cc1cc(C)c(C2=C(OC(=O)C(C)(C)C)CC(Cc3ccccc3)C2=O)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 4/20 0.38
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ ACHE P22303 2/20 0.35
▸ MAPT P10636 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ GAA P10253 1/20 0.33
▸ LTB4R Q15722 1/20 0.32
▸ LTB4R2 Q9NPC1 1/20 0.32

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
SCHEMBL10326978 0.92 ALDH1A1 (0.38) ABCB1ACHEALDH1A1GAA
SCHEMBL10326235 0.91 CCR8 (0.36) ABCB1MEN1KMT2A
SCHEMBL10326979 0.90 ELANE (0.33) LMNAALDH1A1
SCHEMBL987301 0.90 ELANE (0.32) ABCB1KMT2AMAPTLMNANPSR1
SCHEMBL12948988 0.90 CYP26A1 (0.34) ABCB1
SCHEMBL10326779 0.89 SPHK1 (0.35) ABCB1MAPT
SCHEMBL10327013 0.89 L3MBTL1 (0.37) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL10326972 0.88 TBXA2R (0.38) ACHEMAPTLMNANPSR1ALDH1A1
SCHEMBL12949064 0.88 CYP26A1 (0.37) ACHEMAPT
SCHEMBL10326958 0.87 TBXA2R (0.33) ABCB1KMT2AMAPTLMNAALDH1A1

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
US-8791303-B2 Herbicides SYNGENTA LIMITED (GB) 2014-07-29 — — US disclosed
US-8791303-B2 Herbicides SYNGENTA LIMITED (GB) 2014-07-29 — — US disclosed
US-20120178623-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-07-12 — — US disclosed
US-20120178623-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-07-12 — — US disclosed
WO-2011007146-A1 HERBICIDALLY ACTIVE 2-(SUBSTITUTED-PHENYL)-CYCLOPENTANE-1,3-DIONE DERIVATIVES SYNGENTA LIMITED (GB) 2011-01-20 — — 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-20120178623-A1 NOVEL HERBICIDES DDT, CBR3, C9 ABCB1 1565/4885MEN1 2870/4885KMT2A 1337/4885

“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.

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