SCHEMBL6668472

SCHEMBL6668472

O=C([O-])[C@@](O)([SbH2])[C@@H](O)[C@H](O)[C@H](O)CO.[Na+]

nearest known ligand 0.47

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 7)

geneUniProtsupporting neighboursconfidence
PDE4A known ✓ P27815 1/20 0.36
CA4 known ✓ P22748 1/20 0.30
LMNA P02545 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.37
TDP1 Q9NUW8 1/20 0.36
USP2 O75604 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34

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
SCHEMBL8967965 0.80 LMNA (0.50) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL11501996 0.77 LMNA (0.47) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL8968603 0.74 LMNA (0.53) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL11870178 0.74 LMNA (0.44) LMNAL3MBTL1PDE4ATDP1USP2
Zinc Ion SCHEMBL14920928 0.74 LMNA (0.44) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL4727419 0.74 LMNA (0.44) LMNAL3MBTL1PDE4ATDP1USP2
Potassium Ion SCHEMBL11501588 0.73 LMNA (0.42) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL6813499 0.73 LMNA (0.42) LMNAL3MBTL1PDE4ATDP1USP2
Mannitol SCHEMBL27645017 0.71 LMNA (0.73) LMNAL3MBTL1PDE4ATDP1USP2
SCHEMBL2520025 0.70 LMNA (0.40) LMNAL3MBTL1PDE4ATDP1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348467-A1 Heteroaryl Derivative, Preparation Method Therefor, And Use Thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2023-11-02 US disclosed
CN-110256336-A Nitogen-contained heterocycle derivant with 2- imino group and the pest control agent comprising it 明治制果药业株式会社 2019-09-20 CN disclosed
CN-109705032-A Nitogen-contained heterocycle derivant with 2- imino group and the pest control agent comprising it 明治制果药业株式会社 2019-05-03 CN disclosed
CN-108495862-A Topical formulations 亚尼塔公司 2018-09-04 CN disclosed
CN-107445940-A Quinzolone derivatives as 5 substitutions of antitumor agent 细胞基因公司 2017-12-08 CN disclosed
CN-106083812-A The solid form of 3 (5 amino 2 methyl 4 oxygen 4H quinazoline 3 base) piperidines 2,6 diketone and pharmaceutical composition thereof and purposes 细胞基因公司 2016-11-09 CN disclosed
CN-105899196-A Formulations of (S) -3- (4- ((4- (morpholinylmethyl) benzyloxy) -1-oxoisoindolin-2-yl) piperidine-2, 6-dione 细胞基因公司 2016-08-24 CN disclosed
CN-103562197-B Solid forms of 3- (5-amino-2-methyl-4-oxo-4H-quinazolin-3-yl) -piperidine-2, 6-dione, and pharmaceutical compositions and uses thereof CELGENE CORP. (US) 2016-05-11 CN disclosed
CN-105142615-A The formulation cell company established the state of cyclopropanecarboxylic acid {2- [ (1S) -1- (3-ethoxy-4-methoxy-phenyl) -2-methanesulfonyl-ethyl ] -3-oxo-2, 3-dihydro-1H-isoindol-4-yl } -amide: state of telahua CELGENE CORP 2015-12-09 CN disclosed
CN-105017212-A 5-substituted quinazolinone derivatives using as antineoplastic agent CELGENE CORP 2015-11-04 CN disclosed
CN-102281897-A Vaccination of poxvirus vectors by mechanical disruption of the epidermis 2011-12-14 CN disclosed
CN-102112463-A 5-substituted isoindoline compounds CELGENE CORP 2011-06-29 CN disclosed
CN-101679380-A 4' -O-substituted isoindoline derivatives and compositions comprising and methods of use CELGENE CORP 2010-03-24 CN disclosed
CN-101578277-A 5-substituted isoindoline compounds CELGENE CORP (US) 2009-11-11 CN disclosed
CN-101535291-A 5-substituted quinazolinone derivatives as antitumor agents CELGENE CORP (US) 2009-09-16 CN disclosed
CN-101340931-A Modulation of tlr-mediated immune responses using adaptor oligonucleotides COLEY PHARM GMBH (DE) 2009-01-07 CN disclosed
CN-101005828-A Compositions comprising a mucoadhesive protein and an activeprinciple for mucosal delivery of said agents VIRUN INC (US) 2007-07-25 CN disclosed
CN-1678188-A Nucleic acid compositions for modulating immune responses COLEY PHARM GROUP INC (US) 2005-10-05 CN disclosed
WO-2004019956-A1 ORGANOPHOSPHOROUS COMPOUNDS FOR THE TREATMENT OF HELMINTHIC INFECTIONS BIOAGENCY AG (DE) 2004-03-11 WO disclosed
US-5232441-A Method of treating schistosomal infestations by iontophoresis PHYSION S.R.L. (IT) 1993-08-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230348467-A1 Heteroaryl Derivative, Preparation Method Therefor, And Use Thereof PTPN11, PTPN1, PTPN7 PDE4A 724/4885CA4 2439/4885LMNA 4818/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.