SCHEMBL5131391

SCHEMBL5131391

CN(CCOCC(=O)N1CCC(O)(Cc2ccccc2)CC1)S(=O)(=O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AVPR1A P37288 3/20 0.47
▸ ALDH1A1 P00352 3/20 0.47
▸ HPGD P15428 2/20 0.47
▸ HTT P42858 2/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ LMNA P02545 1/20 0.45
▸ BDKRB1 P46663 11/20 0.44
▸ KDM4E B2RXH2 1/20 0.42
▸ ADRB2 P07550 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ PKLR P30613 1/20 0.41

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
SCHEMBL5132318 0.93 ALDH1A1 (0.52) ALDH1A1HPGDHTTCYP2C9BDKRB1
SCHEMBL5131099 0.89 PKLR (0.54) AVPR1AALDH1A1HPGDHTTBDKRB1
SCHEMBL3812962 0.88 ALDH1A1 (0.50) ALDH1A1HPGDHTTCYP2C9LMNA
SCHEMBL3818478 0.86 BDKRB1 (0.47) BDKRB1
SCHEMBL5125258 0.84 BDKRB1 (0.44) AVPR1ABDKRB1
SCHEMBL5128208 0.84 BDKRB1 (0.44) BDKRB1PKLR
SCHEMBL3828061 0.83 BDKRB1 (0.49) BDKRB1
SCHEMBL5128650 0.77 BDKRB1 (0.54) BDKRB1
SCHEMBL5123851 0.77 AVPR1A (0.46) AVPR1AALDH1A1HPGDLMNAKDM4E
SCHEMBL3412888 0.77 BDKRB1 (0.67) BDKRB1

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-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 — — US claimed
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 2737/4885HPGD 667/4885

“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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