SCHEMBL11944170

SCHEMBL11944170

CCCS(=O)(=O)N1CCN(c2cnn(-c3cccc(F)c3)c(=O)c2O[C@@H]2CCC[C@H]2C)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.44
▸ CYP3A4 P08684 2/20 0.42
▸ CYP2C19 P33261 2/20 0.42
▸ POLB P06746 1/20 0.42
▸ PPARG P37231 1/20 0.42
▸ NCOA2 Q15596 1/20 0.42
▸ NCOA1 Q15788 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ NCOA3 Q9Y6Q9 1/20 0.42
▸ KDM4E B2RXH2 2/20 0.41
▸ GLA P06280 1/20 0.41
▸ ALDH1A1 P00352 2/20 0.37
▸ DCTPP1 Q9H773 1/20 0.37
▸ SLC2A1 P11166 1/20 0.36
▸ SLC2A3 P11169 1/20 0.36
▸ SCN9A Q15858 1/20 0.35
▸ SCN10A Q9Y5Y9 1/20 0.35
▸ F2R P25116 1/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35

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
SCHEMBL11944279 0.89 ALDH1A1 (0.48) MAPTCYP3A4CYP2C19POLBPPARG
SCHEMBL11944171 0.89 MAPT (0.45) MAPTCYP3A4CYP2C19POLBPPARG
SCHEMBL11943996 0.88 MAPT (0.47) MAPTCYP3A4CYP2C19POLBPPARG
SCHEMBL11944281 0.87 POLB (0.43) MAPTCYP3A4CYP2C19POLBPPARG
SCHEMBL11944982 0.85 MAPT (0.44) MAPTCYP3A4CYP2C19POLBPPARG
SCHEMBL11945055 0.84 MAPT (0.48) MAPTCYP3A4CYP2C19POLBPPARG
SCHEMBL17058294 0.84 SLC2A1 (0.41) CYP3A4CYP2C19POLBPPARGNCOA2
SCHEMBL11945120 0.83 MAPT (0.52) MAPTCYP3A4CYP2C19POLBPPARG
SCHEMBL11944367 0.83 KDM4E (0.52) MAPTPOLBKDM4EGLAALDH1A1
SCHEMBL17058058 0.82 MCHR1 (0.38) CYP3A4CYP2C19POLBPPARGNCOA2

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 2295/4885CYP3A4 281/4885CYP2C19 461/4885

“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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