SCHEMBL11945009

SCHEMBL11945009

O=c1c(OCCCc2ccccc2)c(N2CCN(S(=O)(=O)c3cccs3)CC2)cnn1-c1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.48
▸ TSHR P16473 2/20 0.48
▸ GAA P10253 1/20 0.48
▸ KDM4E B2RXH2 2/20 0.47
▸ PKM P14618 4/20 0.46
▸ RAB9A P51151 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ USP2 O75604 1/20 0.44
▸ DCTPP1 Q9H773 1/20 0.44
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ MAPK1 P28482 2/20 0.43
▸ POLB P06746 1/20 0.43
▸ HTT P42858 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 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
SCHEMBL11943889 0.90 MAPT (0.53) MAPTTSHRGAAKDM4EPKM
SCHEMBL11945016 0.90 MAPT (0.50) MAPTTSHRGAAKDM4EPKM
SCHEMBL11943872 0.90 MAPT (0.52) MAPTTSHRGAAKDM4EPKM
SCHEMBL11945008 0.89 MAPT (0.54) MAPTTSHRGAAKDM4EPKM
SCHEMBL11944993 0.89 MAPT (0.52) MAPTTSHRGAAKDM4EPKM
SCHEMBL11943873 0.89 MAPT (0.52) MAPTTSHRGAAKDM4EPKM
SCHEMBL11943875 0.89 MAPT (0.52) MAPTTSHRGAAKDM4EPKM
SCHEMBL11944990 0.89 MAPT (0.52) MAPTTSHRGAAKDM4EPKM
SCHEMBL11944991 0.89 MAPT (0.52) MAPTTSHRGAAKDM4EPKM
SCHEMBL11943865 0.89 MAPT (0.52) MAPTTSHRGAAKDM4EPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 — — US disclosed
US-8232274-B2 Pyridazinone derivatives useful as glucan synthase inhibitors ALBANY MOLECULAR RESEARCH, INC. (US) 2012-07-31 — — US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 — — US disclosed
US-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors SCHERING CORPORATION AND ALBANY MOLECULAR RESEARCH, INC. 2009-07-02 — — 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-20090170861-A1 Pyridazinone Derivatives Useful as Glucan Synthase Inhibitors MAN2A1, GYS2, MANBA MAPT 2295/4885TSHR 4729/4885GAA 21/4885

“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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