SCHEMBL1493809

SCHEMBL1493809

O=C(COS(=O)(=O)c1ccccc1)NC(=O)N1CCCC1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.47
▸ POLB P06746 1/20 0.47
▸ HPGD P15428 2/20 0.46
▸ RAB9A P51151 2/20 0.46
▸ HTT P42858 2/20 0.46
▸ TP53 P04637 1/20 0.46
▸ LMNA P02545 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ FAAH O00519 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ EPHX2 P34913 1/20 0.42
▸ CA12 O43570 1/20 0.41
▸ CA1 P00915 1/20 0.41
▸ CA2 P00918 1/20 0.41
▸ CA9 Q16790 1/20 0.41
▸ STAT3 P40763 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ NAMPT P43490 1/20 0.40

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
SCHEMBL1493731 0.81 POLB (0.60) SMN1; SMN2POLBHPGDRAB9AHTT
SCHEMBL10932120 0.74 STAT3 (0.61) POLBHPGDRAB9AHTTALDH1A1
SCHEMBL27810403 0.74 STAT3 (0.50) GAASMN1; SMN2POLBALDH1A1CA12
SCHEMBL3965227 0.74 STAT3 (0.47) HTTALDH1A1CA12CA1CA2
SCHEMBL7412504 0.73 GAA (0.57) GAASMN1; SMN2POLBHPGDRAB9A
SCHEMBL27765152 0.73 POLB (0.51) SMN1; SMN2POLBHPGDRAB9AHTT
SCHEMBL8066357 0.72 GAA (0.59) GAASMN1; SMN2POLBHPGDRAB9A
SCHEMBL9243189 0.71 ALOX15 (0.47) SMN1; SMN2POLBALDH1A1STAT3
SCHEMBL9243186 0.70 ENPP3 (0.43) SMN1; SMN2HPGDALDH1A1MAPTSTAT3
SCHEMBL28659206 0.70 ALOX15 (0.45) SMN1; SMN2POLBALDH1A1MAPTSTAT3

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-7915427-B2 Process for producing aminoacetyl pyrrolidine carbonitrile derivative and intermediate for production thereof KYORIN PHARMACEUTICALS CO., LTD. (JP) 2011-03-29 — — US disclosed
US-20090048454-A1 Process for Producing Aminoacetyl Pyrrolidine Carbonitrile Derivative and Intermediate for Production Thereof KYORIN PHARMACEUTICALS CO., LTD. (JP) 2009-02-19 — — 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-20090048454-A1 Process for Producing Aminoacetyl Pyrrolidine Carbonitrile Derivative and Intermediate for Production Thereof CBR3, CPS1, CBR1 GAA 3647/4885SMN1; SMN2 3794/4885POLB 3310/4885

“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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