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 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 known ✓ | P14867 | 3/20 | 0.36 |
| ▸ | GABRG2 known ✓ | P18507 | 3/20 | 0.36 |
| ▸ | GABRB3 known ✓ | P28472 | 3/20 | 0.36 |
| ▸ | GABRA5 known ✓ | P31644 | 3/20 | 0.36 |
| ▸ | GABRA3 known ✓ | P34903 | 3/20 | 0.36 |
| ▸ | GABRA2 known ✓ | P47869 | 3/20 | 0.36 |
| ▸ | GABRP known ✓ | O00591 | 2/20 | 0.36 |
| ▸ | GABRD known ✓ | O14764 | 2/20 | 0.36 |
| ▸ | GABRB1 known ✓ | P18505 | 2/20 | 0.36 |
| ▸ | GABRB2 known ✓ | P47870 | 2/20 | 0.36 |
| ▸ | GABRA4 known ✓ | P48169 | 2/20 | 0.36 |
| ▸ | GABRE known ✓ | P78334 | 2/20 | 0.36 |
| ▸ | GABRA6 known ✓ | Q16445 | 2/20 | 0.36 |
| ▸ | GABRG1 known ✓ | Q8N1C3 | 2/20 | 0.36 |
| ▸ | GABRG3 known ✓ | Q99928 | 2/20 | 0.36 |
| ▸ | GABRQ known ✓ | Q9UN88 | 2/20 | 0.36 |
| ▸ | PDE3B known ✓ | Q13370 | 2/20 | 0.35 |
| ▸ | PDE3A known ✓ | Q14432 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30967483 | 0.85 | XDH (0.40) | KDM4EALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL30967503 | 0.81 | GABRA1 (0.38) | KDM4EGABRA1GABRG2GABRB3GABRA5 | |
| SCHEMBL30967524 | 0.74 | HIPK2 (0.43) | KDM4EALDH1A1LMNAHSD17B10PDE3B | |
| SCHEMBL31092842 | 0.70 | ALDH1A1 (0.52) | KDM4EALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL24020812 | 0.70 | KDM4E (0.48) | KDM4EALDH1A1MAPTLMNAHPGD | |
| SCHEMBL30310570 | 0.70 | KDM4E (0.48) | KDM4EALDH1A1MAPTLMNAHPGD | |
| SCHEMBL24019765 | 0.69 | NUDT1 (0.47) | KDM4EALDH1A1NPC1RAB9AMAPT | |
| SCHEMBL23102527 | 0.69 | CYP1A2 (0.44) | KDM4EALDH1A1MAPTLMNAHPGD | |
| SCHEMBL30310440 | 0.69 | CYP1A2 (0.44) | KDM4EALDH1A1MAPTLMNAHPGD | |
| Hydrochloric Acid SCHEMBL29761726 | 0.69 | KDM4E (0.47) | KDM4EALDH1A1MAPTLMNAHPGD |
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-4615838-A1 | SUBSTITUTED BI-AND TRICYCLIC HSET INHIBITORS | Merck Patent GmbH (DE) | 2025-09-17 | — | — | EP | disclosed |
| WO-2024099898-A1 | SUBSTITUTED BI-AND TRICYCLIC HSET INHIBITORS | MERCK PATENT GMBH (DE) | 2024-05-16 | — | — | WO | disclosed |