SCHEMBL11944165

SCHEMBL11944165

C[C@@H]1CCC[C@H]1Oc1c(N2CCN(S(=O)(=O)Cc3ccccc3)CC2)cnn(C2CCCCC2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.42
▸ HPGD P15428 2/20 0.39
▸ TSHR P16473 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ HTT P42858 1/20 0.38
▸ KMT2A Q03164 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
SCHEMBL11944214 0.89 HPGD (0.43) POLBHPGDTSHRMAPTALDH1A1
SCHEMBL11944270 0.88 HPGD (0.44) POLBHPGDTSHRMAPTALDH1A1
SCHEMBL11944164 0.87 KDM4E (0.39) MAPTALDH1A1HSD17B10KMT2A
SCHEMBL11944293 0.87 MAPT (0.43) POLBHPGDTSHRMAPTALDH1A1
SCHEMBL11944267 0.86 ALDH1A1 (0.40) ALDH1A1NPSR1LMNASMN1; SMN2
SCHEMBL11944327 0.85 POLB (0.46) POLBHPGDTSHRMAPTALDH1A1
SCHEMBL11944278 0.83 CCND1 (0.33) ALDH1A1
SCHEMBL11944290 0.83 MAPT (0.41) POLBHPGDMAPTALDH1A1NPSR1
SCHEMBL11944171 0.81 MAPT (0.45) POLBMAPTALDH1A1NPSR1MAPK1
SCHEMBL11944514 0.76 HPGD (0.38) POLBHPGDTSHRMAPTALDH1A1

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 1088/4885HPGD 690/4885TSHR 4729/4885

“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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