Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 known ✓ | P35354 | 7/20 | 0.46 |
| ▸ | ALOX5 known ✓ | P09917 | 4/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 2/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.39 |
| ▸ | FUT7 | Q11130 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16050638 | 1.00 | GPR84 (0.69) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL17678365 | 0.85 | GPR84 (0.53) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL29555599 | 0.84 | ALDH1A1 (0.56) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL16050413 | 0.84 | ALDH1A1 (0.56) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL19166809 | 0.84 | GPR84 (0.51) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL17678366 | 0.84 | GPR84 (0.51) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL17672982 | 0.84 | GPR84 (0.67) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL1160403 | 0.83 | PTGS2 (0.63) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL25346230 | 0.83 | GPR84 (0.50) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 | |
| SCHEMBL19166230 | 0.83 | PTGS2 (0.50) | GPR84PTGS2CYP3A4ALDH1A1ALOX5 |
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-4225724-A1 | SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF | Pharmaceutique Ingenew Inc. (CA) | 2023-08-16 | — | — | EP | disclosed |
| WO-2022073115-A1 | SUBSTITUTED AROMATIC COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF | BIOPHARMACEUTIQUES INGENEW INC. (CA) | 2022-04-14 | — | — | WO | disclosed |