SCHEMBL315622

SCHEMBL315622

CC(=O)c1nc(C)cn1NS(=O)(=O)N(C)C

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.30
HPGD P15428 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL10040086 0.73 KDM4E (0.36) HTTMEN1HPGDKMT2A
SCHEMBL13287986 0.65 SMN1; SMN2 (0.35) HTTHPGDKMT2A
SCHEMBL10070241 0.65 SMN1; SMN2 (0.35) HTTHPGDKMT2A
SCHEMBL26241847 0.61 SMN1; SMN2 (0.36) KMT2A
SCHEMBL14151520 0.59 KDM4E (0.33) MEN1KMT2A
SCHEMBL25151812 0.58
SCHEMBL14151742 0.58 SORD (0.33)
SCHEMBL25852448 0.55 KDM4E (0.30)
SCHEMBL10423801 0.54 ALDH1A1 (0.34) MEN1HPGDKMT2A
SCHEMBL18773508 0.54 SCN9A (0.40) HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8404732-B2 Methods of treating ulcerative colitis LEXICON PHARMACEUTICALS, INC. (US) 2013-03-26 US disclosed
US-20130005775-A1 METHODS OF TREATING ULCERATIVE COLITIS LEXICON PHARMACEUTICALS, INC. (US) 2013-01-03 US disclosed
US-8093267-B2 Methods of treating rheumatoid arthritis LEXICON PHARMACEUTICALS, INC. (US) 2012-01-10 US disclosed
CN-102196808-A S1P lyase inhibitors for the treatment of cerebral malaria LEXICON PHARMACEUTICALS INC 2011-09-21 CN disclosed
CN-101878030-A Compositions and methods for treating immunological and inflammatory diseases and disorders LEXICON PHARMACEUTICALS INC 2010-11-03 CN disclosed
US-7825150-B2 Compositions and methods for treating immunological and inflammatory diseases and disorders LEXICON PHARMACEUTICALS, INC. (US) 2010-11-02 US disclosed
US-20100113530-A1 S1P LYASE INHIBITORS FOR THE TREATMENT OF CEREBRAL MALARIA LEXICON PHARMACEUTICALS, INC. 2010-05-06 US disclosed
US-20100076030-A1 METHODS OF TREATING RHEUMATOID ARTHRITIS LEXICON PHARMACEUTICALS, INC. (US) 2010-03-25 US disclosed
CN-101395141-A Imidazolyl compounds, compositions comprising the same, and methods of use thereof LEXICON PHARMACEUTICALS INC (US) 2009-03-25 CN disclosed
US-20090068180-A1 COMPOSITIONS AND METHODS FOR TREATING IMMUNOLOGICAL AND INFLAMMATORY DISEASES AND DISORDERS OXFORD FINANCE LLC, AS COLLATERAL AGENT 2009-03-12 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 (4 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-20100113530-A1 S1P LYASE INHIBITORS FOR THE TREATMENT OF CEREBRAL MALARIA S1PR1, S1PR2, SPHK1 HTT 4672/4885MEN1 2252/4885HPGD 948/4885
US-20090068180-A1 COMPOSITIONS AND METHODS FOR TREATING IMMUNOLOGICAL AND INFLAMMATORY DISEASES AND DISORDERS ASAH2, SGMS1, SMPD1 HTT 4304/4885MEN1 2262/4885HPGD 666/4885
US-20100076030-A1 METHODS OF TREATING RHEUMATOID ARTHRITIS SSB, NFKBIA, MPO HTT 3411/4885MEN1 4596/4885HPGD 243/4885
US-20130005775-A1 METHODS OF TREATING ULCERATIVE COLITIS SI, S1PR2, SPHK2 HTT 4882/4885MEN1 4464/4885HPGD 145/4885

“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.