SCHEMBL10326972

SCHEMBL10326972

Cc1cc(C)c(C2=C(OC(=O)C(C)(C)C)CC(Cc3ccccc3C)C2=O)c(C)c1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ TBXA2R P21731 2/20 0.38
▸ CYP26A1 O43174 1/20 0.36
▸ CYP24A1 Q07973 1/20 0.36
▸ ACHE P22303 14/20 0.36
▸ LMNA P02545 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ ELANE P08246 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ GLA P06280 1/20 0.31

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
SCHEMBL10326767 0.92 TBXA2R (0.35) TBXA2RACHELMNAMAPTNPSR1
SCHEMBL10326979 0.85 ELANE (0.33) LMNAELANEKDM4EALDH1A1
SCHEMBL987301 0.84 ELANE (0.32) TBXA2RLMNAMAPTNPSR1ELANE
SCHEMBL10326978 0.84 ALDH1A1 (0.38) TBXA2RACHEALDH1A1
SCHEMBL430481 0.84 SSTR4 (0.33) TBXA2RACHE
SCHEMBL430457 0.84 PDE4D (0.38) LMNAMAPTNPSR1GLA
SCHEMBL10326957 0.83 ELANE (0.31) ELANE
SCHEMBL12948988 0.82 CYP26A1 (0.34) TBXA2RCYP26A1ELANE
SCHEMBL430494 0.82 ACHE (0.34) TBXA2RACHELMNA
SCHEMBL10326235 0.82 CCR8 (0.36) —

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 TBXA2R 4701/4885CYP26A1 740/4885CYP24A1 682/4885

“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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