SCHEMBL303601

SCHEMBL303601

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

nearest known ligand 0.70

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 15)

geneUniProtsupporting neighboursconfidence
CA1 known ✓ P00915 4/20 0.70
CA2 known ✓ P00918 2/20 0.48
NFKB1 P19838 1/20 0.53
GPR84 Q9NQS5 1/20 0.47
BBOX1 O75936 2/20 0.47
FFAR3 O14843 1/20 0.44
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
KDM4C Q9H3R0 2/20 0.43
KDM4A O75164 1/20 0.43
PHF8 Q9UPP1 1/20 0.43
KDM2A Q9Y2K7 1/20 0.43
FABP3 P05413 1/20 0.41

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
Zinc Ion SCHEMBL27829213 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
Methyl Alcohol SCHEMBL27994833 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
SCHEMBL29662052 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
SCHEMBL10406238 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
SCHEMBL10815605 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
SCHEMBL28808939 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
SCHEMBL8378952 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
SCHEMBL29457257 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
SCHEMBL11656700 0.98 CA1 (0.67) CA1NFKB1CA2GPR84BBOX1
SCHEMBL28587416 0.98 CA1 (0.68) CA1NFKB1CA2GPR84BBOX1

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 1471 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122036754-A Cefazolin sodium method for preparing anhydrous substance 河北合佳创新医药科技有限公司 2026-05-15 CN claimed
CN-122010942-A Chemical synthesis method of avibactam sodium 山东安信制药有限公司 2026-05-12 CN claimed
CN-119954694-A Bumetat preparation process of nylon 海南卓科制药有限公司 2025-05-09 CN claimed
CN-222752627-U Filter equipment of iso-octoic acid sodium salt in iso-octoic acid production 开封市禹泓新材料有限公司 2025-04-15 CN claimed
CN-119735601-A Superfine cefoxitin sodium and method for continuously preparing superfine cefoxitin sodium 华北制药河北华民药业有限责任公司 2025-04-01 CN claimed
CN-119638722-A Coupled crystallization method for preparing dicloxacillin sodium superior product 天津大学 2025-03-18 CN claimed
CN-119613386-A Ralset tilobal 1, 4-dioxane solvent compound and preparation method thereof 杭州科巢生物科技有限公司 2025-03-14 CN claimed
CN-119524865-A Method for simulated preparation of industrial iron pollution catalytic cracking catalyst 中国石油天然气股份有限公司 2025-02-28 CN claimed
CN-119461944-A UPR artificial stone moisture-heat yellowing resistant accelerator composition, and preparation method and application thereof 广东热浪新材料科技有限公司 2025-02-18 CN claimed
CN-119409694-A Beta-lactam compound, crystal form, preparation method and application thereof 广州艾奇西新药研究有限公司 2025-02-11 CN claimed
CN-1603350-A Method for synthesizing high solid content vinyl acetate-ethylene copolymer emulsion BEIJING ORIENTAL PETROCHEMICAL (CN) 2005-04-06 CN claimed
CN-1597684-A Sodium ceftriaxone and its preparation method GUANGZHOU BAIYUNSHAN PHARMACEU (CN) 2005-03-23 CN claimed
CN-1594324-A Process for preparing cefpiramide sodium GUANGZHOU BAIYUNSHAN MEDICAL T (CN) 2005-03-16 CN claimed
CN-1583756-A Preparing method for amoxicillin by solvent crystallization PHARMACEUTICAL GENERAL FACTORY (CN) 2005-02-23 CN claimed
CN-1183140-C Prepn of amoxcillion sodium 河北张药股份有限公司 2005-01-05 CN claimed
CN-1513854-A Cynnematin having chelated crystalline hydrate and its preparation method 中国药品生物制品检定所 2004-07-21 CN claimed
CN-1116297-C Method for preparing sodium amoxicillin ZHANGYAO CO LTD HEBEI (CN) 2003-07-30 CN claimed
CN-1362412-A Prepn of amoxcillion sodium HEBEI ZHANGYAO CO (CN) 2002-08-07 CN claimed
CN-1306962-A Method for preparing sodium amoxicillin ZHANGYAO CO LTD HEBEI (CN) 2001-08-08 CN claimed
CN-1261069-A Process for preparing sodium isooctoate JINTONG MEDIO CHEMICAL CO LTD (CN) 2000-07-26 CN claimed