SCHEMBL1546827

SCHEMBL1546827

O=S(=O)(N1CCCC1)N1CCCC1

nearest known ligand 0.87

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.87
KMT2A Q03164 4/20 0.81
TSHR P16473 3/20 0.81
KDM4E B2RXH2 1/20 0.65
SMN1; SMN2 Q16637 3/20 0.57
L3MBTL1 Q9Y468 3/20 0.57
ALDH1A1 P00352 7/20 0.56
MEN1 O00255 3/20 0.56
CA1 P00915 2/20 0.56
CA2 P00918 2/20 0.56
CA12 O43570 1/20 0.53
CA7 P43166 1/20 0.53
CA14 Q9ULX7 1/20 0.53
LMNA P02545 1/20 0.48
HPGD P15428 1/20 0.48
USP2 O75604 1/20 0.43
MAPT P10636 2/20 0.43
HTT P42858 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
CRHBP P24387 1/20 0.43

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
SCHEMBL5280013 0.96 POLB (0.93) POLBKMT2ATSHRKDM4ESMN1; SMN2
SCHEMBL5314300 0.92 KMT2A (0.81) POLBKMT2ATSHRKDM4ESMN1; SMN2
SCHEMBL10751242 0.84
SCHEMBL18713004 0.83 POLB (0.70) POLBKMT2ATSHRKDM4ESMN1; SMN2
SCHEMBL16439724 0.83 KDM4E (0.95) POLBKMT2ATSHRKDM4ESMN1; SMN2
SCHEMBL6962582 0.81 POLB (0.67) POLBKMT2ATSHRKDM4ESMN1; SMN2
SCHEMBL9028142 0.81 POLB (0.67) POLBKMT2ATSHRKDM4ESMN1; SMN2
SCHEMBL3176249 0.81 KDM4E (1.00) POLBKMT2ATSHRKDM4ESMN1; SMN2
SCHEMBL7955480 0.79 POLB (0.56) POLBKMT2ATSHRKDM4ESMN1; SMN2
SCHEMBL2422007 0.77 POLB (0.61) POLBKMT2ATSHRKDM4ESMN1; SMN2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3261639-B1 SUBSTITUTED PYRAZOLE COMPOUNDS AS SERINE PROTEASE INHIBITORS VERSEON INT CORPORATION (US) 2022-08-24 EP claimed
US-11165097-B2 Electrolyte, electrochemical device and electronic device containing the same NINGDE AMPEREX TECHNOLOGY LIMITED (CN) 2021-11-02 US disclosed
US-20200243905-A1 ELECTROLYTE, ELECTROCHEMICAL DEVICE AND ELECTRONIC DEVICE CONTAINING THE SAME NINGDE AMPEREX TECHNOLOGY LIMITED 2020-07-30 US disclosed
CN-106061971-B Pyrrolidinyl sulfone derivatives and their use as ROR gamma modulators 百时美施贵宝公司 2019-03-12 CN disclosed
CN-106061971-B Pyrrolidinyl sulfone derivatives and their use as ROR gamma modulators 百时美施贵宝公司 2019-03-12 CN disclosed
CN-105102449-B Antiviral compound 豪夫迈·罗氏有限公司 2017-06-13 CN disclosed
CN-106061971-A Pyrrolidinyl sulfone derivatives and their use as ROR gamma modulators 百时美施贵宝公司 2016-10-26 CN disclosed
CN-106061971-A Pyrrolidinyl sulfone derivatives and their use as ROR gamma modulators 百时美施贵宝公司 2016-10-26 CN disclosed
US-9458171-B2 Pyrrolidinyl sulfone RORγ modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2016-10-04 US disclosed
CN-105102449-A Antiviral compounds HOFFMANN LA ROCHE 2015-11-25 CN disclosed
US-7851463-B2 Heterocyclic compounds suitable for treating disorders that respond to modulation of the dopamine D3 receptor ABBOTT GMBH & CO. KG (DE) 2010-12-14 US disclosed
WO-2010118367-A2 ANTIVIRAL PYRIMIDINES PROGENICS PHARMACEUTICALS, INC. (US) 2010-10-14 WO disclosed
US-20090306175-A1 HETEROCYCLIC ARYLSULPHONES SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2009-12-10 US disclosed
CN-101421234-A Is suitable for treating p-hydroxytryptamine 5HT6Heterocyclic aryl sulfones of receptor-modulated responsive disorders ABBOTT GMBH (DE) 2009-04-29 CN disclosed
EP-2029528-A1 HETEROCYCLIC ARYLSULPHONES SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5HT6 RECEPTOR Abbott GmbH & Co. KG (DE) 2009-03-04 EP disclosed
US-20080045493-A1 Heterocyclic Compounds Suitable For Treating Disorders That Respond To Modulation Of The Dopamine D3 Receptor ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2008-02-21 US disclosed
WO-2007118899-A1 HETEROCYCLIC ARYLSULPHONES SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5HT6 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2007-10-25 WO disclosed
CN-101039904-A Is suitable for treating dopamine D3Heterocyclic compounds for receptor-modulated responsive disorders ABBOTT GMBH & CO KG (DE) 2007-09-19 CN disclosed
EP-1814849-A1 HETEROCYCLIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR Abbott GmbH & Co. KG (DE) 2007-08-08 EP disclosed
WO-2006040182-A1 HETEROCYCLIC COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE DOPAMINE D3 RECEPTOR ABBOTT GMBH & CO. KG (DE) 2006-04-20 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 (3 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-20090306175-A1 HETEROCYCLIC ARYLSULPHONES SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5HT6 RECEPTOR HTR6, HTR1A, HTR5A POLB 4814/4885KMT2A 1530/4885TSHR 107/4885
US-20080045493-A1 Heterocyclic Compounds Suitable For Treating Disorders That Respond To Modulation Of The Dopamine D3 Receptor DRD3, MC3R, CHRNA3 POLB 4018/4885KMT2A 2936/4885TSHR 38/4885
US-11165097-B2 Electrolyte, electrochemical device and electronic device containing the same CA3, SCNN1G, SCN10A POLB 2163/4885KMT2A 940/4885TSHR 2512/4885

“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.