SCHEMBL11944368

SCHEMBL11944368

O=c1c(OC2CCCC2)c(N2CCN(S(=O)(=O)Cc3ccc(Cl)c(Cl)c3)CC2)cnn1-c1cccc(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.47
▸ NPSR1 Q6W5P4 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ CYP3A4 P08684 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ NCOA2 Q15596 1/20 0.47
▸ NCOA1 Q15788 1/20 0.47
▸ NCOA3 Q9Y6Q9 1/20 0.47
▸ MAPT P10636 1/20 0.44
▸ TP53 P04637 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.39
▸ DCTPP1 Q9H773 1/20 0.39
▸ NPBWR1 P48145 1/20 0.38
▸ MCHR1 Q99705 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ PTPN11 Q06124 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
SCHEMBL11944287 0.93 POLB (0.48) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11944273 0.93 POLB (0.47) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11944175 0.91 POLB (0.47) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11943960 0.91 MAPT (0.51) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11945191 0.90 POLB (0.46) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11944152 0.90 MAPT (0.47) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11944272 0.90 POLB (0.56) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11945151 0.90 MAPT (0.50) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11944211 0.90 POLB (0.45) PPARGNPSR1POLBCYP3A4CYP2C19
SCHEMBL11944294 0.90 MAPT (0.46) PPARGNPSR1POLBCYP3A4CYP2C19

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 PPARG 2194/4885NPSR1 4251/4885POLB 1088/4885

“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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