SCHEMBL11946142

SCHEMBL11946142

CN1CCN(c2cnn(-c3cc(F)cc(F)c3)c(=O)c2OC[C@H]2C[C@@H]2COS(C)(=O)=O)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ CYP3A4 P08684 8/20 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
▸ ALDH1A1 P00352 9/20 0.33
▸ CASP1 P29466 7/20 0.33
▸ CASP7 P55210 7/20 0.33
▸ USP2 O75604 7/20 0.33
▸ CYP1A2 P05177 6/20 0.33
▸ HSD17B10 Q99714 6/20 0.33
▸ HIF1A Q16665 6/20 0.33
▸ CYP2C9 P11712 4/20 0.33
▸ GLA P06280 1/20 0.33

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
SCHEMBL11946141 0.89 POLB (0.39) POLBSMN1; SMN2KMT2ALMNACYP3A4
SCHEMBL11946144 0.89 POLB (0.39) POLBSMN1; SMN2KMT2ALMNACYP3A4
SCHEMBL11946143 0.88 POLB (0.39) POLBSMN1; SMN2KMT2ALMNACYP3A4
SCHEMBL11946148 0.80 POLB (0.36) POLBCYP3A4CYP2C19PPARGNCOA2
SCHEMBL11946145 0.78 CYP3A4 (0.34) POLBKMT2ALMNACYP3A4CYP2C19
SCHEMBL17058088 0.77 ALDH1A1 (0.35) KMT2ALMNACYP3A4CYP2C19NPSR1
SCHEMBL11944854 0.76 ALDH1A1 (0.44) POLBSMN1; SMN2KMT2ALMNACYP3A4
SCHEMBL14899749 0.76 SMN1; SMN2 (0.45) POLBSMN1; SMN2KMT2ALMNACYP3A4
SCHEMBL11946146 0.76 MAPT (0.42) POLBKMT2ALMNACYP3A4CYP2C19
SCHEMBL11946220 0.76 MAPT (0.39) POLBCYP3A4CYP2C19PPARGNCOA2

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 POLB 1088/4885SMN1; SMN2 3911/4885KMT2A 3312/4885

“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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