SCHEMBL5012736

SCHEMBL5012736

CCCCCCCCCCCCC(CC(=O)[O-])C(=O)[O-].[Na+].[Na+]

nearest known ligand 0.75

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 10)

geneUniProtsupporting neighboursconfidence
CA2 known ✓ P00918 2/20 0.75
CA1 known ✓ P00915 3/20 0.55
GPR84 Q9NQS5 8/20 0.53
NFKB1 P19838 3/20 0.52
CYP3A4 P08684 2/20 0.52
TSHR P16473 2/20 0.52
NPSR1 Q6W5P4 2/20 0.52
GRIK1 P39086 1/20 0.43
GRIK2 Q13002 1/20 0.43
FFAR1 O14842 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL29053765 1.00 CA2 (0.75) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL7704955 1.00 CA2 (0.75) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL9158148 1.00 CA2 (0.75) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL5690631 1.00 CA2 (0.75) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL7704238 1.00 CA2 (0.75) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL29176448 1.00 CA2 (0.75) CA2CA1GPR84NFKB1CYP3A4
Zinc Ion SCHEMBL8623779 0.96 CA2 (0.69) CA2CA1GPR84NFKB1CYP3A4
Lithium Ion SCHEMBL11432144 0.96 CA2 (0.69) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL27218453 0.96 CA2 (0.69) CA2CA1GPR84NFKB1CYP3A4
SCHEMBL9451802 0.96 CA2 (0.69) CA2CA1GPR84NFKB1CYP3A4

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 144 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122081838-A High-strength galvanized steel wire and preparation method thereof 2026-05-26 CN claimed
EP-4349318-B1 COSMETIC COMPOSITION IN THE FORM OF CLEANSING DRY BEADS TECHNATURE (FR) 2025-07-16 EP claimed
CN-119925226-A Anti-drop oil-control anti-dandruff shampoo and preparation method thereof 蝶泉(广东)生物科技有限公司 2025-05-06 CN claimed
CN-119424225-A Selenium sulfide stable emulsifying system, application and shampoo 广东嘉丹婷日用品有限公司 2025-02-14 CN claimed
CN-119406585-A Full-size-fraction flotation method for lepidolite ore containing mud 昆明理工大学 2025-02-11 CN claimed
CN-119280116-A Long-acting oil-control anti-dandruff composition and preparation method and application thereof 广州环亚化妆品科技股份有限公司 2025-01-10 CN claimed
CN-119241119-A Gas-liquid-solid three-phase foam stabilizer and high-strength autoclaved aerated concrete plate 青岛科技大学 2025-01-03 CN claimed
CN-119185156-A Propolis liposome gel and preparation method and application thereof 北京中蜜科技发展有限公司 2024-12-27 CN claimed
CN-118766778-A Amino acid composition for selective cleaning, product and preparation method thereof 广州稀咖科技有限公司 2024-10-15 CN claimed
CN-113507917-B Skin and hair care actives with physicochemical modification properties 西姆莱斯有限公司 2024-09-03 CN claimed
CN-117202882-A Solid and powdery formulations 拜尔斯道夫股份有限公司 2023-12-08 CN claimed
CN-117202883-A Cosmetic concentrate in the form of a film 拜尔斯道夫股份有限公司 2023-12-08 CN claimed
CN-117202884-A Powdered cleaning composition 拜尔斯道夫股份有限公司 2023-12-08 CN claimed
CN-116869871-A Anti-dandruff shampoo and preparation method thereof 广州顶冠生物有限公司 2023-10-13 CN claimed
CN-115813841-B Anti-dandruff itching-relieving composition, preparation method and application thereof, shampoo and preparation method 广东迪美新材料科技有限公司 2023-09-05 CN claimed
CN-113679638-B Sensitive creatine mild and clean facial cleanser and preparation method thereof 广东星芮生物科技有限公司 2023-07-21 CN claimed
CN-116159013-A Amino acid facial cleanser containing ore powder and cellulose particles and preparation method thereof 中科未来(无锡)生物技术研究院有限公司 2023-05-26 CN claimed
CN-116145440-A Triacetic acid fabric plant coloring agent 苏州名科纺织科技有限公司 2023-05-23 CN claimed
CN-114031957-B Preparation method and application of nano graphite powder with heat storage and heat conduction functions 深圳清华大学研究院 2022-11-15 CN claimed
CN-114031957-A Preparation method and application of nano graphite powder with heat storage and heat conduction functions 深圳清华大学研究院 2022-02-11 CN claimed