Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | CES2 | O00748 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.34 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.34 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.34 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4659041 | 0.90 | CHRM2 (0.39) | MAPTHTTCHRM2CHRM1CYP4F2 | |
| SCHEMBL4660361 | 0.88 | KMT2A (0.39) | — | |
| SCHEMBL4660356 | 0.88 | ESR1 (0.35) | CHRM2CHRM1ADRB2ADRB1ADRB3 | |
| SCHEMBL4659042 | 0.87 | MAPT (0.35) | MAPTHTTHTR2CCHRM2CHRM1 | |
| SCHEMBL4660377 | 0.85 | POLB (0.39) | KDM4EMAPTHTTCHRM2CHRM1 | |
| SCHEMBL1158253 | 0.85 | CHRM2 (0.45) | CHRM2CHRM1ADRB2CYP4F2CYP4A11 | |
| SCHEMBL4659056 | 0.84 | ALOX5 (0.41) | MAPTACHE | |
| Hydrochloric Acid SCHEMBL16166428 | 0.84 | CHRM2 (0.45) | CHRM2CHRM1ADRB2CYP4F2CYP4A11 | |
| SCHEMBL4660393 | 0.83 | MEN1 (0.36) | HTTCHRM2CHRM1ADRB2ADRB1 | |
| SCHEMBL4660337 | 0.83 | LPAR1 (0.40) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2004592-A1 | SYNTHESIS OF PHENOLIC ESTERS OF HYDROXYMETHYL PHENOLS | Schwarz Pharma Ltd. (IE) | 2008-12-24 | — | — | EP | disclosed |
| WO-2007140986-A1 | SYNTHESIS OF PHENOLIC ESTERS OF HYDROXYMETHYL PHENOLS | SCHWARZ PHARMA LTD (IE) | 2007-12-13 | — | — | WO | disclosed |