SCHEMBL3193754

SCHEMBL3193754

CC(=O)Nc1sc2ccccc2c1-c1cccs1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.48
▸ GAA P10253 4/20 0.48
▸ GFER P55789 1/20 0.48
▸ PKM P14618 2/20 0.46
▸ ALDH1A1 P00352 7/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ MAPK1 P28482 2/20 0.44
▸ KDM4E B2RXH2 6/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ HPGD P15428 3/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ESR1 P03372 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ ADORA3 P0DMS8 1/20 0.43
▸ ADORA2A P29274 1/20 0.43
▸ POLB P06746 3/20 0.43
▸ TP53 P04637 1/20 0.43
▸ TDP1 Q9NUW8 2/20 0.42

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
SCHEMBL11189958 0.75 PKM (0.43) MAPTGAAGFERPKMALDH1A1
SCHEMBL13833660 0.73 MAPT (0.66) MAPTGAASMN1; SMN2KDM4ENPC1
SCHEMBL28471303 0.72 TOP2A (0.48) MAPTGAAGFERPKMALDH1A1
SCHEMBL8329259 0.72 ABCC1 (0.63) MAPTGAAPKMALDH1A1MAPK1
SCHEMBL28065441 0.71 MAPT (0.47) MAPTGAAGFERALDH1A1SMN1; SMN2
SCHEMBL29273210 0.71 L3MBTL1 (0.42) MAPTGAAPKMALDH1A1SMN1; SMN2
SCHEMBL4059329 0.70 ABCC1 (0.50) MAPTGAAGFERPKMALDH1A1
SCHEMBL6654580 0.70 LMNA (0.63) MAPTGAAPKMALDH1A1SMN1; SMN2
SCHEMBL6249721 0.70 GAA (0.47) MAPTGAAPKMALDH1A1SMN1; SMN2
SCHEMBL7244186 0.69 FABP4 (0.46) MAPTGAASMN1; SMN2KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8486986-B2 Microbiocides SYNGENTA CROP PROTECTION LLC (US) 2013-07-16 — — US disclosed
US-8202894-B2 Microbiocides SYNGENTA CROP PROTECTION LLC (US) 2012-06-19 — — US disclosed
US-20100227898-A1 NOVEL MICROBIOCIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-09-09 — — US disclosed
US-20100222389-A1 NOVEL MICROBIOCIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-09-02 — — US disclosed
EP-2170858-A2 NOVEL MICROBIOCIDES Syngeta Participations AG (CH) 2010-04-07 — — EP disclosed
EP-2167486-A2 NOVEL MICROBIOCIDES Syngeta Participations AG (CH) 2010-03-31 — — EP disclosed
WO-2009003672-A2 NOVEL MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-01-08 — — WO disclosed
WO-2008151828-A2 NOVEL MICROBIOCIDES SYNGETA PARTICIPATIONS AG (CH) 2008-12-18 — — 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 (2 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-20100227898-A1 NOVEL MICROBIOCIDES FPR1, CD14, MSR1 MAPT 4783/4885GAA 1449/4885GFER 2144/4885
US-20100222389-A1 NOVEL MICROBIOCIDES CD14, FPR1, MPO MAPT 4756/4885GAA 1358/4885GFER 2143/4885

“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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