SCHEMBL2801877

SCHEMBL2801877

Cc1ccc(S(=O)(=O)On2nnc3ccccc32)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC9A1 P19634 2/20 0.59
VDR P11473 1/20 0.49
NOD1 Q9Y239 3/20 0.46
ALDH3A1 P30838 2/20 0.46
POLB P06746 2/20 0.46
HTT P42858 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
KEAP1 Q14145 1/20 0.46
NFE2L2 Q16236 1/20 0.46
GAA P10253 3/20 0.44
CXCL8 P10145 1/20 0.44
NOD2 Q9HC29 1/20 0.44
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RXFP1 Q9HBX9 1/20 0.43
RAB9A P51151 3/20 0.43
NPC1 O15118 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
MGAM O43451 1/20 0.43
AMY1A P0DUB6 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
SCHEMBL2803342 0.88 SLC9A1 (0.55) SLC9A1POLBKEAP1GAATSHR
SCHEMBL28569854 0.86 TSHR (0.47) SLC9A1POLBTSHRNPSR1RXFP1
SCHEMBL9817222 0.86 CYP2C19 (0.59) SLC9A1NOD1ALDH3A1HTTL3MBTL1
SCHEMBL28479855 0.84 TSHR (0.46) SLC9A1POLBTSHRNPSR1RXFP1
SCHEMBL11448910 0.82 KMT2A (0.62) SLC9A1NOD1GAATSHRNPSR1
SCHEMBL27903206 0.82 KMT2A (0.46) SLC9A1VDRPOLBTSHRNPSR1
SCHEMBL7383122 0.81 KMT2A (0.45) SLC9A1VDRPOLBHTTNPSR1
SCHEMBL11450935 0.81 SLC9A1 (0.44) SLC9A1POLBHTTGAATSHR
SCHEMBL30695198 0.81 LMNA (0.48) SLC9A1POLBHTTGAATSHR
SCHEMBL19136732 0.81 LMNA (0.48) SLC9A1POLBHTTGAATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1251120-B1 ESTERS DERIVED FROM (RR,SS)-2-HYDROXYBENZOATE OF 3-(2-DIMETHYLAMINOMETHYL-1-HYDROXYCYCLOHEXYL)PHENYL VITA LAB (ES) 2004-12-08 EP claimed
US-20260137765-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF INSTITUT CURIE (FR) 2026-05-21 US disclosed
US-12527854-B2 Methods of producing Shiga toxin B-subunit (STxB) monomers and oligomers, and uses thereof INSTITUT CURIE (FR) 2026-01-20 US disclosed
EP-3856164-B1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS ACHILLION PHARMACEUTICALS INC (US) 2024-08-07 EP disclosed
US-11807627-B2 Morphic forms of complement factor D inhibitors Achillon Pharmaceuticals, Inc. (US) 2023-11-07 US disclosed
US-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES Atea Pharmaceuticals, Inc. (US) 2023-10-19 US disclosed
US-20220233673-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STxB) MONOMERS AND OLIGOMERS, AND USES THEREOF INSTITUT CURIE (FR) 2022-07-28 US disclosed
EP-3980057-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF Institut Curie (FR) 2022-04-13 EP disclosed
US-20210332026-A1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS ACHILLION PHARMACEUTICALS, INC. (US) 2021-10-28 US disclosed
EP-3856164-A1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS Achillion Pharmaceuticals, Inc. (US) 2021-08-04 EP disclosed
US-20140221340-A1 CHEMOKINE RECEPTOR ACTIVITY REGULATOR KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-08-07 US disclosed
US-8729264-B2 Agent for prevention and/or treatment of skin diseases KYOWA HAKKO KIRIN CO., LTD. (JP) 2014-05-20 US disclosed
WO-2014008236-A1 PROCESS FOR PREPARING DIASTEREOMERICALLY ENRICHED PHOSPHORAMIDATE DERIVATIVES OF NUCLEOSIDE COMPOUNDS FOR TREATMENT OF VIRAL INFECTIONS BRISTOL-MYERS SQUIBB COMPANY (US) 2014-01-09 WO disclosed
US-20130102620-A1 PYRAZOLOPYRIMIDINE DERIVATIVE KYOWA HAKKO KIRIN CO., LTD. (JP) 2013-04-25 US disclosed
EP-2543670-A1 PYRAZOLOPYRIMIDINE DERIVATIVE Kyowa Hakko Kirin Co., Ltd. (JP) 2013-01-09 EP disclosed
US-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES KYOWA HAKKO KIRIN CO., LTD. (JP) 2010-10-07 US disclosed
EP-2206714-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES Kyowa Hakko Kirin Co., Ltd. (JP) 2010-07-14 EP disclosed
CN-1023014-C Improvements in or relating to ergoline derivatives LILLY CO ELI (US) 1993-12-08 CN disclosed
CN-1043715-A The preparation method of ergoline derivatives LILLY CO ELI (US) 1990-07-11 CN disclosed
US-4242507-A Sulfonic acid esters FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-12-30 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 (8 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-12527854-B2 Methods of producing Shiga toxin B-subunit (STxB) monomers and oligomers, and uses thereof STXBP1, RNGTT, UPF1 SLC9A1 3272/4885VDR 4197/4885NOD1 1516/4885
US-20140221340-A1 CHEMOKINE RECEPTOR ACTIVITY REGULATOR CXCR2, ACKR3, CCR2 SLC9A1 1742/4885VDR 407/4885NOD1 830/4885
US-11807627-B2 Morphic forms of complement factor D inhibitors CFD, CFH, CFB SLC9A1 4745/4885VDR 286/4885NOD1 666/4885
US-20260137765-A1 METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STXB) MONOMERS AND OLIGOMERS, AND USES THEREOF STXBP1, HBB, UPF1 SLC9A1 2068/4885VDR 4055/4885NOD1 2305/4885
US-20130102620-A1 PYRAZOLOPYRIMIDINE DERIVATIVE GRK3, NR3C2, NR1I3 SLC9A1 1253/4885VDR 41/4885NOD1 2759/4885
US-20230331751-A1 STEREOSELECTIVE MANUFACTURE OF SELECTED PURINE PHOSPHORAMIDATES NUDT1, PNP, ATIC SLC9A1 343/4885VDR 3704/4885NOD1 173/4885
US-20210332026-A1 MORPHIC FORMS OF COMPLEMENT FACTOR D INHIBITORS CFD, CFH, CFB SLC9A1 4745/4885VDR 286/4885NOD1 666/4885
US-20100256134-A1 AGENT FOR PREVENTION AND/OR TREATMENT OF SKIN DISEASES TYR, CUTA, SERPINB1 SLC9A1 118/4885VDR 281/4885NOD1 670/4885

“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.