SCHEMBL11944526

SCHEMBL11944526

O=c1c(OC2CCC(F)C2)c(N2CCN(S(=O)(=O)Cc3ccncc3[N+](=O)[O-])CC2)cnn1-c1cc(F)cc(F)c1

nearest known ligand 0.34

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.34
▸ LMNA P02545 4/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ POLB P06746 3/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ PPARG P37231 1/20 0.34
▸ NCOA2 Q15596 1/20 0.34
▸ NCOA1 Q15788 1/20 0.34
▸ NPSR1 Q6W5P4 1/20 0.34
▸ NCOA3 Q9Y6Q9 1/20 0.34
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ HPGD P15428 1/20 0.32

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
SCHEMBL11945618 0.92 MAPT (0.36) MAPTLMNAALDH1A1POLBCYP3A4
SCHEMBL11944548 0.89 MAPT (0.35) MAPTALDH1A1POLBCYP3A4CYP2C19
SCHEMBL11944395 0.88 POLB (0.35) MAPTLMNAALDH1A1POLBCYP3A4
SCHEMBL11944502 0.86 MAPT (0.38) MAPTLMNAALDH1A1POLBCYP3A4
SCHEMBL11944472 0.86 ALDH1A1 (0.37) MAPTLMNAALDH1A1POLBCYP3A4
SCHEMBL11944515 0.84 MAPT (0.34) MAPTLMNAALDH1A1POLBCYP3A4
SCHEMBL11944409 0.84 MAPT (0.34) MAPTLMNAALDH1A1POLBCYP3A4
SCHEMBL11944979 0.84 MAPT (0.39) MAPTLMNAALDH1A1POLBCYP3A4
SCHEMBL11944798 0.83 MAPT (0.42) MAPTLMNAALDH1A1POLBCYP3A4
SCHEMBL11944800 0.83 POLB (0.40) MAPTLMNAALDH1A1POLBCYP3A4

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 2 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-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 2295/4885LMNA 929/4885ALDH1A1 2437/4885

“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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