SCHEMBL429866

SCHEMBL429866

Cc1cc(C)c(C2C(=O)C/C(=C\c3sccc3C)C2=O)c(C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 11/20 0.47
▸ ALDH1A1 P00352 11/20 0.47
▸ RAB9A P51151 9/20 0.47
▸ NPC1 O15118 6/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ NFKB1 P19838 1/20 0.47
▸ NFKB2 Q00653 1/20 0.47
▸ RELA Q04206 1/20 0.47
▸ KMT2A Q03164 5/20 0.41
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ PKM P14618 2/20 0.41
▸ STAT3 P40763 1/20 0.41
▸ STAT1 P42224 1/20 0.41
▸ MEN1 O00255 3/20 0.39
▸ TDP1 Q9NUW8 2/20 0.39
▸ TNFRSF1A P19438 1/20 0.38
▸ MAPK1 P28482 2/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ CRHBP P24387 1/20 0.34
▸ CRHR2 Q13324 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
SCHEMBL428614 0.75 MAPT (0.43) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL10280041 0.75 MAPT (0.43) MAPTALDH1A1RAB9ANPC1SMN1; SMN2
SCHEMBL427436 0.74 MAOB (0.42) MAPTALDH1A1RAB9ANPC1NPSR1
SCHEMBL430724 0.73 MAPT (0.46) MAPTALDH1A1RAB9ANPC1NPSR1
SCHEMBL429856 0.73 MEN1 (0.36) MAPTALDH1A1RAB9ANPC1KMT2A
SCHEMBL464644 0.73 MAPT (0.48) MAPTALDH1A1RAB9ANPC1NPSR1
SCHEMBL430381 0.73 MAPT (0.48) MAPTALDH1A1RAB9ANPC1NPSR1
SCHEMBL428660 0.73 NPC1 (0.34) MAPTALDH1A1RAB9ANPC1NPSR1
SCHEMBL430382 0.73 — —
SCHEMBL430379 0.72 MAPT (0.47) MAPTALDH1A1RAB9ANPC1NPSR1

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 13 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-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
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-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
US-20120065064-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-03-15 — — US disclosed
EP-2375898-A1 NOVEL HERBICIDES Syngenta Participations AG (CH) 2011-10-19 — — EP disclosed
WO-2010069834-A1 NOVEL HERBICIDES SYNGENTA PARTICIPATIONS AG (CH) 2010-06-24 — — WO 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 MAPT 3792/4885ALDH1A1 10/4885RAB9A 3219/4885

“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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