SCHEMBL2887792

SCHEMBL2887792

Cc1ccc(SCc2ccccc2)cn1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.52
PLA2G7 Q13093 1/20 0.49
HSD17B10 Q99714 1/20 0.47
SLC6A4 P31645 1/20 0.46
MAOA P21397 3/20 0.46
MAOB P27338 3/20 0.46
LMNA P02545 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
GCK P35557 2/20 0.43
RAB9A P51151 1/20 0.42
ALDH1A1 P00352 2/20 0.42
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
CYP2C9 P11712 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
SCHEMBL2889731 0.84 MEN1 (0.57) PLA2G7MAOAMAOBLMNAMEN1
SCHEMBL2886374 0.80 APP (0.58) MAOAMAOBLMNAMEN1KMT2A
SCHEMBL6482247 0.80 L3MBTL1 (0.49) SCN9AHSD17B10SLC6A4MAOAMAOB
SCHEMBL19859227 0.79 SCN9A (0.49) SCN9AHSD17B10SLC6A4MAOAMAOB
SCHEMBL19970154 0.79 SMN1; SMN2 (0.50) SCN9AHSD17B10SLC6A4MAOAMAOB
SCHEMBL29464960 0.79 SMN1; SMN2 (0.50) SCN9AHSD17B10SLC6A4MAOAMAOB
SCHEMBL7947358 0.79 HSD17B10 (0.47) SCN9AHSD17B10SLC6A4MAOAMAOB
SCHEMBL29304015 0.77 KMT2A (0.53) HSD17B10LMNAMEN1KMT2ARAB9A
SCHEMBL31028768 0.76 SCN9A (0.57) SCN9AHSD17B10SLC6A4MAOAMAOB
SCHEMBL31190789 0.76 SCN9A (0.44) SCN9AHSD17B10SLC6A4MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3283472-B1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS UNIV INDIANA RES & TECH CORP (US) 2021-04-14 EP disclosed
US-10273228-B2 Hepatitis B viral assembly effectors INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2019-04-30 US disclosed
US-10273228-B2 Hepatitis B viral assembly effectors INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2019-04-30 US disclosed
CN-107922377-A Hepatitis B virus assembly effector 美国印第安纳大学研究和技术公司 2018-04-17 CN disclosed
US-20180099952-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-04-12 US disclosed
US-20180099952-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-04-12 US disclosed
US-20180099952-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2018-04-12 US disclosed
EP-3283472-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS Indiana University Research&Technology Corporation (US) 2018-02-21 EP disclosed
WO-2016168619-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2016-10-20 WO disclosed
WO-2016168619-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2016-10-20 WO disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
US-20090156642-A1 5-Membered heterocyclic compound TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
WO-2009041705-A2 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-02 WO disclosed
WO-2009041705-A2 5-MEMBERED HETEROCYCLIC COMPOUNDS AS PROTON PUMP INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-02 WO disclosed
US-20080108823-A1 Method For Producing Thioether Compound MSD K.K. (JP) 2008-05-08 US disclosed
US-20080108823-A1 Method For Producing Thioether Compound MSD K.K. (JP) 2008-05-08 US disclosed
US-20080108823-A1 Method For Producing Thioether Compound MSD K.K. (JP) 2008-05-08 US disclosed
CN-101068777-A Process for producing thioether compound BANYU PHARMA CO LTD (JP) 2007-11-07 CN disclosed
EP-1806337-A1 METHOD FOR PRODUCING THIOETHER COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-07-11 EP 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-20180099952-A1 HEPATITIS B VIRAL ASSEMBLY EFFECTORS HAVCR2, MAVS, HCCS SCN9A 4712/4885PLA2G7 173/4885HSD17B10 1642/4885
US-20080108823-A1 Method For Producing Thioether Compound TST, MPST, PPIP5K2 SCN9A 4135/4885PLA2G7 2836/4885HSD17B10 2439/4885
US-20090156642-A1 5-Membered heterocyclic compound CEL, PGA5, COG5 SCN9A 3101/4885PLA2G7 162/4885HSD17B10 281/4885
US-10273228-B2 Hepatitis B viral assembly effectors HAVCR2, MAVS, HCCS SCN9A 4712/4885PLA2G7 173/4885HSD17B10 1642/4885

“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.