SCHEMBL5125142

SCHEMBL5125142

O=C(COC1CCN(S(=O)(=O)c2ccccc2)CC1)N1CCC(O)(Cc2ccccc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 1/20 0.48
ALDH1A1 P00352 7/20 0.47
GAA P10253 5/20 0.47
PKM P14618 4/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
POLB P06746 2/20 0.45
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
HSD17B10 Q99714 1/20 0.43
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
KDM4E B2RXH2 1/20 0.42
HPGD P15428 1/20 0.42
NPC1 O15118 1/20 0.42

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
SCHEMBL5131355 0.94 AVPR1A (0.46) AVPR1AALDH1A1GAAPKMSMN1; SMN2
SCHEMBL5128250 0.88 AVPR1A (0.45) AVPR1AALDH1A1GAAPKMSMN1; SMN2
SCHEMBL5128879 0.88 GAA (0.49) AVPR1AALDH1A1GAAPKMSMN1; SMN2
SCHEMBL5131447 0.88 PKM (0.46) AVPR1AALDH1A1GAAPKMSMN1; SMN2
SCHEMBL5121390 0.88 PKLR (0.49) ALDH1A1GAAPKMSMN1; SMN2POLB
SCHEMBL3828071 0.82 EPHX2 (0.44) ALDH1A1PKMSMN1; SMN2
SCHEMBL3808499 0.82 EPHX2 (0.44) AVPR1AALDH1A1GAAKMT2AMEN1
SCHEMBL5128076 0.81 ATM (0.46) ALDH1A1GAAPKMSMN1; SMN2POLB
SCHEMBL5123851 0.80 AVPR1A (0.46) AVPR1AALDH1A1GAAPKMSMN1; SMN2
SCHEMBL5128193 0.79 MEN1 (0.56) ALDH1A1GAAPKMPOLBKMT2A

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-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US claimed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 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-20080249128-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 AVPR1A 23/4885ALDH1A1 2737/4885GAA 3363/4885

“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.