SCHEMBL429924

SCHEMBL429924

Cc1cc(C)c(C2C(=O)CC(=Cc3ncccc3C)C2=O)c(C)c1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ NPSR1 Q6W5P4 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GAA P10253 1/20 0.33
▸ MEN1 O00255 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ XBP1 P17861 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ NOS3 P29474 1/20 0.30
▸ NOS1 P29475 1/20 0.30
▸ NOS2 P35228 1/20 0.30
▸ ATAD2 Q6PL18 1/20 0.30

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
SCHEMBL13345556 0.91 KDM4E (0.32) KDM4EMAPTSMN1; SMN2NPSR1LMNA
SCHEMBL428566 0.90 KDM4E (0.32) KDM4EMAPTSMN1; SMN2NPSR1LMNA
SCHEMBL428564 0.87 KDM4E (0.33) KDM4EMAPTSMN1; SMN2NPSR1LMNA
SCHEMBL430432 0.87 LMNA (0.35) KDM4EMAPTSMN1; SMN2NPSR1LMNA
SCHEMBL428734 0.86 KDM4E (0.32) KDM4EMAPTSMN1; SMN2NPSR1LMNA
SCHEMBL430381 0.84 MAPT (0.48) KDM4EMAPTSMN1; SMN2NPSR1LMNA
SCHEMBL464644 0.84 MAPT (0.48) KDM4EMAPTSMN1; SMN2NPSR1LMNA
SCHEMBL429932 0.82 MAOA (0.41) KDM4EMAPTSMN1; SMN2LMNAMEN1
SCHEMBL10280577 0.80 MAPT (0.48) MAPTSMN1; SMN2NPSR1LMNAMEN1
SCHEMBL428525 0.80 MAPT (0.48) MAPTSMN1; SMN2NPSR1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2997824-A1 NOVEL HERBICIDES Syngenta Participations AG. (CH) 2016-03-23 — — EP disclosed
EP-2375898-B1 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2015-09-16 — — EP disclosed
US-8889595-B2 Herbicides SYNGENTA PARTICIPATIONS AG (CH) 2014-11-18 — — US disclosed
US-8889595-B2 Herbicides SYNGENTA PARTICIPATIONS AG (CH) 2014-11-18 — — US disclosed
US-20120065064-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-03-15 — — US disclosed
WO-2010069834-A1 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-06-24 — — 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-20120065064-A1 NOVEL HERBICIDES DDT, CYP1B1, CYP4X1 KDM4E 1210/4885MAPT 3792/4885SMN1; SMN2 2773/4885

“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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