SCHEMBL23309641

SCHEMBL23309641

O=C(NSc1ccccc1)c1cc(F)nc(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 1/20 0.36
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ GCK P35557 1/20 0.32
▸ GAA P10253 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ NCOA1 Q15788 1/20 0.31
▸ NCOA3 Q9Y6Q9 1/20 0.31
▸ DHODH Q02127 1/20 0.30
▸ PDCD1 Q15116 1/20 0.30
▸ CD274 Q9NZQ7 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ GLA P06280 1/20 0.30
▸ L3MBTL1 Q9Y468 1/20 0.30
▸ GPR27 Q9NS67 1/20 0.30
▸ HDAC3 O15379 1/20 0.30
▸ HDAC8 Q9BY41 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
SCHEMBL23309506 0.78 MAPT (0.40) KLKB1MAOAMAOBNCOA1NCOA3
SCHEMBL23309490 0.78 GAA (0.51) MAOAMAOBGAAMEN1NPC1
SCHEMBL23309726 0.77 ALDH1A1 (0.40) MEN1NPC1RAB9AKMT2AALDH1A1
SCHEMBL23309706 0.74 TSHR (0.55) KLKB1MAOBGAAKMT2AL3MBTL1
SCHEMBL23309724 0.72 GAA (0.55) GAANPC1KMT2AALDH1A1L3MBTL1
SCHEMBL23309730 0.72 KMT2A (0.47) MAOAMAOBGAAMEN1NPC1
SCHEMBL23309725 0.72 GAA (0.43) KLKB1MAOAMAOBGAAALDH1A1
SCHEMBL3387152 0.70 KEAP1 (0.42) GAADHODHALDH1A1
SCHEMBL23309507 0.70 NPC1 (0.57) GAAMEN1NPC1RAB9AKMT2A
SCHEMBL23309632 0.70 KDM4E (0.36) KLKB1MEN1NPC1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210120817-A1 PLANT DISEASE CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2021-04-29 — — 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-20210120817-A1 PLANT DISEASE CONTROL AGENT BROX, ALG1, CTRL KLKB1 4243/4885MAOA 1498/4885MAOB 2341/4885

“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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