Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | MMP1 | P03956 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.50 |
| ▸ | MMP8 | P22894 | 1/20 | 0.50 |
| ▸ | MMP13 | P45452 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 6/20 | 0.47 |
| ▸ | CA9 | Q16790 | 6/20 | 0.47 |
| ▸ | F2 | P00734 | 3/20 | 0.46 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.46 |
| ▸ | PRSS2 | P07478 | 3/20 | 0.46 |
| ▸ | PRSS3 | P35030 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | FABP3 | P05413 | 1/20 | 0.44 |
| ▸ | FABP4 | P15090 | 1/20 | 0.44 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28014587 | 0.85 | KMT2A (0.45) | TSHRSMN1; SMN2ALDH1A1KDM4EKMT2A | |
| SCHEMBL27346903 | 0.85 | KDM4E (0.45) | TSHRSMN1; SMN2CA1CA2CA12 | |
| SCHEMBL27643364 | 0.85 | ALDH1A1 (0.44) | TSHRSMN1; SMN2CA1CA2MMP1 | |
| SCHEMBL10425170 | 0.84 | SMN1; SMN2 (0.62) | TSHRSMN1; SMN2CA1CA2MMP1 | |
| SCHEMBL27558162 | 0.84 | FOLH1 (0.46) | TSHRSMN1; SMN2CA1CA2MMP1 | |
| SCHEMBL27601611 | 0.80 | ALDH1A1 (0.47) | TSHRSMN1; SMN2CA1CA2MMP1 | |
| SCHEMBL27481653 | 0.78 | ALDH1A1 (0.43) | TSHRSMN1; SMN2CA1CA2MMP1 | |
| SCHEMBL5724579 | 0.78 | TSHR (0.68) | TSHRSMN1; SMN2CA1CA2MMP1 | |
| SCHEMBL6045544 | 0.78 | CA1 (0.56) | TSHRSMN1; SMN2CA1CA2MMP1 | |
| SCHEMBL27407958 | 0.77 | KDM4E (0.39) | TSHRSMN1; SMN2CA1CA2MMP1 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-55092358-A | — | — | None | — | — | JP | disclosed |
| EP-1044190-B1 | SYNTHESIS OF 11-ARYL-5,6-DIHYDRO-11H-DIBENZ(B,E)AZEPINES | JOHNSON MATTHEY PHARMACEUTICAL (US) | 2005-02-02 | — | — | EP | disclosed |
| US-6124469-A | Process for preparing sulphurous 2-chloro-3-(4,5-dihydroisoxazol-3-yl)-benzoic acids | BASF AKTIENGESELLSCHAFT (DE) | 2000-09-26 | — | — | US | disclosed |
| US-5648525-A | Method for preparation of herbicide intermediates | ZENECA LIMITED (GB) | 1997-07-15 | — | — | US | disclosed |
| US-4990648-A | Process for producing an alkylthiobenzoate | ICI AMERICAS INC. (US) | 1991-02-05 | — | — | US | disclosed |
| US-4990648-A | Process for producing an alkylthiobenzoate | ICI AMERICAS INC. (US) | 1991-02-05 | — | — | US | disclosed |
| WO-1990006915-A1 | PROCESS FOR PRODUCING 2-ALKYL- AND 2-(SUBSTITUTED ALKYL)-4-ALKYLTHIO AND ALKYLSULFONYL-BENZOIC ACIDS AND THEIR DERIVATIVES | ICI AMERICAS INC. (US) | 1990-06-28 | — | — | WO | disclosed |
| WO-1990006915-A1 | PROCESS FOR PRODUCING 2-ALKYL- AND 2-(SUBSTITUTED ALKYL)-4-ALKYLTHIO AND ALKYLSULFONYL-BENZOIC ACIDS AND THEIR DERIVATIVES | ICI AMERICAS INC. (US) | 1990-06-28 | — | — | WO | disclosed |
| US-4925970-A | Process for producing cyclohexadiene thioether | ICI AMERICAS INC., A CORP. OF DE. | 1990-05-15 | — | — | US | disclosed |
| US-4925970-A | Process for producing cyclohexadiene thioether | ICI AMERICAS INC., A CORP. OF DE. | 1990-05-15 | — | — | US | disclosed |
| JP-S5592358-A | PREPARATION OF ALKYLSULFONYLBENZOIC ACID | SEITETSU KAGAKU CO LTD | 1980-07-12 | — | — | JP | disclosed |