SCHEMBL11944327

SCHEMBL11944327

C[C@H]1CC[C@H](Oc2c(N3CCN(S(=O)(=O)Cc4ccccc4)CC3)cnn(C3CCCC3)c2=O)C1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.46
▸ MAPT P10636 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ TSHR P16473 2/20 0.38
▸ GAA P10253 1/20 0.38
▸ CYP2C19 P33261 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL11944293 0.90 MAPT (0.43) POLBMAPTALDH1A1NPSR1HPGD
SCHEMBL11944270 0.89 HPGD (0.44) POLBMAPTALDH1A1NPSR1HPGD
SCHEMBL11944214 0.89 HPGD (0.43) POLBMAPTALDH1A1NPSR1HPGD
SCHEMBL11944372 0.87 KDM4E (0.39) MAPTALDH1A1HSD17B10PKMGAA
SCHEMBL11944222 0.86 ALDH1A1 (0.40) ALDH1A1NPSR1HSD17B10HTTTSHR
SCHEMBL11944165 0.85 POLB (0.42) POLBMAPTALDH1A1NPSR1HPGD
SCHEMBL11944223 0.83 CCND1 (0.33) ALDH1A1
SCHEMBL11944501 0.82 MAPT (0.44) POLBMAPTALDH1A1NPSR1HTT
SCHEMBL11944013 0.81 MAPT (0.49) POLBMAPTALDH1A1NPSR1PKM
SCHEMBL11945321 0.81 MAPT (0.49) POLBMAPTALDH1A1HTTLMNA

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 POLB 1088/4885MAPT 2295/4885ALDH1A1 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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