Known targets — ChEMBL curated mechanism
ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of Tetrahydrothiophene. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL8037750 | 0.97 | FFAR3 (0.44) | — | |
| Acetic Acid SCHEMBL28746199 | 0.97 | FFAR3 (0.44) | — | |
| Tetrahydrothiophene SCHEMBL9620648 | 0.90 | — | — | |
| Acetone SCHEMBL7399782 | 0.87 | LMNA (0.40) | — | |
| Acetone SCHEMBL28864865 | 0.87 | LMNA (0.40) | — | |
| Acetone SCHEMBL7399779 | 0.87 | LMNA (0.40) | — | |
| Tetrahydrothiophene SCHEMBL20550228 | 0.86 | — | — | |
| Acetic Acid SCHEMBL8037754 | 0.86 | FFAR3 (0.54) | — | |
| Methacrylic Acid SCHEMBL16146329 | 0.81 | TDP1 (0.33) | — | |
| Pyridine SCHEMBL1629138 | 0.81 | TSHR (0.39) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116425706-A | Preparation method of caronic anhydride | 能特科技有限公司 | 2023-07-14 | — | — | CN | claimed |
| US-4571437-A | CATALYTIC HYDROGENATION REDUCTION AND REARRANGEMENT OF NITROBENZENE IN PRESENCE OF SULFUR COMPOUND | MALLINCKRODT, INC. (US) | 1986-02-18 | — | — | US | claimed |
| CN-116425706-A | Preparation method of caronic anhydride | 能特科技有限公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-116425706-A | Preparation method of caronic anhydride | 能特科技有限公司 | 2023-07-14 | — | — | CN | disclosed |
| US-5442065-A | Antitumor agents | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 1995-08-15 | — | — | US | disclosed |
| EP-0454330-A1 | Benzimidazolinone derivatives | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1991-10-30 | — | — | EP | disclosed |