SCHEMBL11946137

SCHEMBL11946137

CCC1(COc2c(N3CCN(S(=O)(=O)Cc4ccccc4)CC3)cnn(-c3cc(F)cc(F)c3)c2=O)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.46
▸ ALDH1A1 P00352 3/20 0.39
▸ DCTPP1 Q9H773 1/20 0.39
▸ CYP2C19 P33261 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ PPARG P37231 1/20 0.38
▸ NCOA2 Q15596 1/20 0.38
▸ NCOA1 Q15788 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ NCOA3 Q9Y6Q9 1/20 0.38
▸ GAA P10253 2/20 0.38
▸ TSHR P16473 2/20 0.38
▸ MAPK1 P28482 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ HSD11B1 P28845 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SLC2A1 P11166 1/20 0.34
▸ SLC2A3 P11169 1/20 0.34

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
SCHEMBL11944464 0.93 MAPT (0.43) MAPTALDH1A1DCTPP1CYP2C19POLB
SCHEMBL11946128 0.92 MAPT (0.39) MAPTALDH1A1DCTPP1CYP2C19POLB
SCHEMBL11946196 0.92 MAPT (0.39) MAPTALDH1A1DCTPP1CYP2C19POLB
SCHEMBL11945310 0.90 MAPT (0.42) MAPTALDH1A1DCTPP1CYP2C19POLB
SCHEMBL11945453 0.90 MAPT (0.45) MAPTALDH1A1DCTPP1CYP2C19POLB
SCHEMBL11944469 0.90 MAPT (0.41) MAPTALDH1A1DCTPP1CYP2C19POLB
SCHEMBL11946129 0.90 MAPT (0.37) MAPTALDH1A1CYP2C19POLBCYP3A4
SCHEMBL11944568 0.89 MAPT (0.40) MAPTALDH1A1DCTPP1CYP2C19POLB
SCHEMBL11945264 0.88 MAPK1 (0.41) MAPTALDH1A1DCTPP1CYP2C19POLB
SCHEMBL11946162 0.87 MAPT (0.41) MAPTALDH1A1DCTPP1CYP2C19POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2137179-B1 PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS MERCK SHARP & DOHME (US) 2015-09-02 — — EP disclosed
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 2295/4885ALDH1A1 2437/4885DCTPP1 625/4885

“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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