Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 3/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.42 |
| ▸ | CXCR1 | P25024 | 2/20 | 0.42 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | RARB | P10826 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | NR1I3 | Q14994 | 1/20 | 0.42 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.42 |
| ▸ | CXCL8 | P10145 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL21514036 | 0.86 | PTGS1 (0.45) | PTGS1PTGS2CYP2C9LMNAAKR1C3 | |
| SCHEMBL20977279 | 0.83 | MAOB (0.37) | CYP2C9ESR1TSHRMAOBHDAC8 | |
| SCHEMBL28148449 | 0.83 | MAOB (0.37) | CYP2C9TSHRMAOBHDAC8 | |
| SCHEMBL16070603 | 0.83 | MAOB (0.37) | CYP2C9ESR1TSHRMAOBHDAC8 | |
| SCHEMBL1131597 | 0.80 | PTGS1 (0.56) | PTGS1PTGS2CYP2C9LMNAAKR1C3 | |
| SCHEMBL9264238 | 0.78 | HDAC8 (0.35) | ESR1MAOBHDAC8 | |
| SCHEMBL2320821 | 0.77 | CYP2A6 (0.58) | PTGS1PTGS2CYP2C9LMNAAKR1C3 | |
| SCHEMBL2324471 | 0.77 | PTGS1 (0.47) | PTGS1PTGS2CYP2C9LMNAAKR1C3 | |
| SCHEMBL27826842 | 0.77 | PTGS1 (0.42) | PTGS1PTGS2CYP2C9LMNAAKR1C3 | |
| SCHEMBL5174938 | 0.77 | PTGS1 (0.54) | PTGS1PTGS2CYP2C9LMNAAKR1C3 |
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 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2421852-B9 | HETEROAROMATIC AND AROMATIC PIPERAZINYL AZETIDINYL AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITOR | JANSSEN PHARMACEUTICA NV (BE) | 2015-07-01 | — | — | EP | claimed |
| EP-2421852-B1 | HETEROAROMATIC AND AROMATIC PIPERAZINYL AZETIDINYL AMIDES AS MONOACYLGLYCEROL LIPASE INHIBITOR | JANSSEN PHARMACEUTICA NV (BE) | 2014-05-21 | — | — | EP | claimed |
| EP-1214300-B1 | RATE-CONTROLLED PARTICLES | ABBOTT GMBH & CO KG (DE) | 2003-09-03 | — | — | EP | claimed |
| EP-0744391-B1 | Process for the preparation of aromatic acetyles using palladacyclen as acatalysts | AVENTIS RES & TECH GMBH & CO (DE) | 2001-09-26 | — | — | EP | claimed |
| US-5886240-A | Process for preparing aromatic acetylenes using palladacycles as catalysts | HOECHST AKTIENGESELLSCHAFT (DE) | 1999-03-23 | — | — | US | claimed |
| EP-0480455-B1 | Optically active thienotriazolodiazepine compounds | YOSHITOMI PHARMACEUTICAL (JP) | 1997-01-22 | — | — | EP | claimed |
| EP-0338852-B1 | Process for the carbonylation of arylalkyl halides | HOECHST CELANESE CORP (US) | 1994-11-30 | — | — | EP | claimed |
| EP-0322068-B1 | DERIVATIVES OF THIAZOLIDINE-4-CARBOXYLIC ACID HAVING PHARMACOLOGICAL ACTIVITY | ZAMBON GROUP S.p.A. (IT) | 1993-07-28 | — | — | EP | claimed |
| EP-0254354-B1 | PHARMACEUTICALLY USEFUL DERIVATIVES OF THIAZOLIDINE-4-CARBOXYLIC ACID | ZAMBON S.p.A. (IT) | 1993-03-31 | — | — | EP | claimed |
| US-4288457-A | Ethynylbenzene compounds and derivatives thereof | WILLIAM H. RORER, INC. (US) | 1981-09-08 | — | — | US | claimed |
| US-4075354-A | ETHYNYLBENZENE COMPOUNDS AND DERIVATIVES THEREOF FOR TREATING PAIN FEVER AND INFLAMMATION | WILLIAM H. RORER, INC. (US) | 1978-02-21 | — | — | US | claimed |
| WO-2021123394-A1 | G PROTEIN-COUPLED RECEPTOR MODULATORS AND A PHARMACEUTICAL COMPOSITION | UNIVERSITY OF COPENHAGEN (DK) | 2021-06-24 | — | — | WO | disclosed |
| EP-2883865-B1 | Compound capable of binding S1P receptor and pharmaceutical use thereof | ONO PHARMACEUTICAL CO (JP) | 2019-09-25 | — | — | EP | disclosed |
| CN-105073710-A | Novel hydroxamic acid derivative or salt thereof | TOYAMA CHEMICAL CO LTD | 2015-11-18 | — | — | CN | disclosed |
| EP-2883865-A1 | Compound capable of binding S1P receptor and pharmaceutical use thereof | ONO PHARMACEUTICAL CO., LTD. (JP) | 2015-06-17 | — | — | EP | disclosed |
| US-4093737-A | Ethynylbenzene compounds and derivatives thereof in the treatment of pain, fever or inflammation | WILLIAM H. RORER, INC. (US) | 1978-06-06 | — | — | US | disclosed |
| US-4075354-A | ETHYNYLBENZENE COMPOUNDS AND DERIVATIVES THEREOF FOR TREATING PAIN FEVER AND INFLAMMATION | WILLIAM H. RORER, INC. (US) | 1978-02-21 | — | — | US | disclosed |
| US-4073936-A | Hypolipidemic allene carboxylic esters | SANDOZ, INC. (US) | 1978-02-14 | — | — | US | disclosed |
| US-4011339-A | ANTIINFLAMMATORY AGENTS | SANDOZ, INC. (US) | 1977-03-08 | — | — | US | disclosed |
| US-3981932-A | Ethynylbenzene compounds and derivatives thereof | WILLIAM H. RORER, INC. (US) | 1976-09-21 | — | — | US | disclosed |