SCHEMBL11945478

SCHEMBL11945478

O=c1c(OCc2ccccc2)c(N2CCN(S(=O)(=O)c3cc(Cl)cc(Cl)c3O)CC2)cnn1-c1cccc(Cl)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 8/20 0.50
▸ POLB P06746 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ CYP2C19 P33261 1/20 0.50
▸ PPARG P37231 1/20 0.50
▸ NCOA2 Q15596 1/20 0.50
▸ NCOA1 Q15788 1/20 0.50
▸ NPSR1 Q6W5P4 1/20 0.50
▸ NCOA3 Q9Y6Q9 1/20 0.50
▸ MAPT P10636 1/20 0.45
▸ ALDH1A1 P00352 4/20 0.44
▸ DCTPP1 Q9H773 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ PKM P14618 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ LMNA P02545 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ TRPV4 Q9HBA0 1/20 0.39

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
SCHEMBL11945480 0.87 POLB (0.50) ACLYPOLBCYP3A4CYP2C19PPARG
SCHEMBL11944392 0.86 ALDH1A1 (0.60) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11944393 0.85 MAPT (0.53) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11944510 0.85 POLB (0.51) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11944523 0.85 POLB (0.51) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11946335 0.84 POLB (0.50) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11945390 0.84 MAPT (0.52) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11944512 0.84 POLB (0.50) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11944335 0.84 POLB (0.50) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11945557 0.84 POLB (0.48) POLBCYP3A4CYP2C19PPARGNCOA2

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 ACLY 360/4885POLB 1088/4885CYP3A4 281/4885

“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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