SCHEMBL19463562

SCHEMBL19463562

N/C(=N/Nc1ccccc1)S(=O)(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.49
MAPT P10636 4/20 0.49
KDM4E B2RXH2 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
CA1 P00915 5/20 0.43
CA2 P00918 5/20 0.43
CA4 P22748 3/20 0.43
CA7 P43166 1/20 0.43
ALDH1A1 P00352 4/20 0.42
LMNA P02545 4/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
HTT P42858 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
TP53 P04637 1/20 0.41
TYR P14679 1/20 0.41
TSHR P16473 1/20 0.41
TAS2R38 P59533 1/20 0.41
HSD17B10 Q99714 1/20 0.41
HPGD P15428 1/20 0.40
CA9 Q16790 2/20 0.39

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
SCHEMBL19463563 1.00 GAA (0.49) GAAMAPTKDM4ENPSR1CA1
SCHEMBL24253615 0.81 CA1 (0.47) GAAMAPTKDM4ECA1CA2
SCHEMBL2746282 0.74 GAA (0.53) GAAMAPTKDM4ENPSR1ALDH1A1
SCHEMBL10826852 0.72 GAA (0.47) GAAMAPTKDM4ENPSR1CA1
SCHEMBL21816341 0.72 GAA (0.47) GAAMAPTKDM4ENPSR1CA1
SCHEMBL3930232 0.72 GAA (0.47) GAAMAPTKDM4ENPSR1CA1
SCHEMBL3930237 0.72 GAA (0.47) GAAMAPTKDM4ENPSR1CA1
SCHEMBL10826850 0.72 GAA (0.47) GAAMAPTKDM4ENPSR1CA1
Sulfuric Acid SCHEMBL8745492 0.71 ACP1 (0.44) GAAMAPTKDM4ECA1CA2
SCHEMBL9841099 0.71 ACP1 (0.44) GAAMAPTKDM4ECA1CA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190055217-A1 PIPERIDINYLALKYLAMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2019-02-21 US disclosed
EP-3442959-A1 PIPERIDINYLALKYLAMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN ESTEVE PHARMACEUTICALS, S.A. (ES) 2019-02-20 EP disclosed
WO-2017178515-A1 PIPERIDINYLALKYLAMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2017-10-19 WO 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-20190055217-A1 PIPERIDINYLALKYLAMIDE DERIVATIVES HAVING MULTIMODAL ACTIVITY AGAINST PAIN OPRD1, OPRK1, OPRM1 GAA 1694/4885MAPT 2603/4885KDM4E 3959/4885

“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.