SCHEMBL430379

SCHEMBL430379

Cc1cc(C)c(C2C(=O)CC(=Cc3cccn3C)C2=O)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 13/20 0.47
▸ KMT2A Q03164 11/20 0.47
▸ MEN1 O00255 10/20 0.47
▸ TDP1 Q9NUW8 6/20 0.47
▸ ALDH1A1 P00352 5/20 0.47
▸ NPSR1 Q6W5P4 5/20 0.47
▸ USP2 O75604 3/20 0.47
▸ GAA P10253 2/20 0.47
▸ TLR9 Q9NR96 2/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ LMNA P02545 1/20 0.47
▸ RAB9A P51151 5/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ NPC1 O15118 3/20 0.46
▸ NFKB1 P19838 2/20 0.46
▸ NFKB2 Q00653 2/20 0.46
▸ RELA Q04206 2/20 0.46
▸ MIF P14174 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.40

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
SCHEMBL430728 0.84 MEN1 (0.33) MAPTKMT2AMEN1TDP1ALDH1A1
SCHEMBL430724 0.74 MAPT (0.46) MAPTKMT2AMEN1TDP1ALDH1A1
SCHEMBL430381 0.74 MAPT (0.48) MAPTKMT2AMEN1TDP1ALDH1A1
SCHEMBL464644 0.74 MAPT (0.48) MAPTKMT2AMEN1TDP1ALDH1A1
SCHEMBL428614 0.73 MAPT (0.43) MAPTALDH1A1KDM4ELMNARAB9A
SCHEMBL10280041 0.73 MAPT (0.43) MAPTALDH1A1KDM4ELMNARAB9A
SCHEMBL429924 0.73 KDM4E (0.33) MAPTKMT2AMEN1ALDH1A1NPSR1
SCHEMBL430400 0.73 ALDH1A1 (0.37) MAPTKMT2AMEN1ALDH1A1NPSR1
SCHEMBL427436 0.72 MAOB (0.42) MAPTKMT2AMEN1TDP1ALDH1A1
SCHEMBL429866 0.72 MAPT (0.47) MAPTKMT2AMEN1TDP1ALDH1A1

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
US-20120065064-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-03-15 — — US 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 MAPT 3792/4885KMT2A 833/4885MEN1 4108/4885

“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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