SCHEMBL2529648

SCHEMBL2529648

O=C([O-])[C@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)CO.O=C([O-])[C@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)CO.O=C([O-])[C@H](O)[C@H](O)[C@H](O)[C@@H](O)[C@H](O)CO.[Fe+3]

nearest known ligand 0.87

Known targets — ChEMBL curated mechanism

rplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

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 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.87
PDE4A P27815 1/20 0.64
TDP1 Q9NUW8 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.50
USP2 O75604 1/20 0.48
SLCO1B1 Q9Y6L6 1/20 0.48
KDM4E B2RXH2 2/20 0.37
OR51E2 Q9H255 1/20 0.33
CYP2C9 P11712 1/20 0.32
TSHR P16473 1/20 0.32
MGAM O43451 1/20 0.32
CA4 P22748 2/20 0.31

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
SCHEMBL2529646 1.00 LMNA (0.87) LMNAPDE4ATDP1L3MBTL1USP2
SCHEMBL9805830 1.00 LMNA (0.87) LMNAPDE4ATDP1L3MBTL1USP2
SCHEMBL9805833 1.00 LMNA (0.87) LMNAPDE4ATDP1L3MBTL1USP2
Gluconic Acid SCHEMBL3768828 0.98 LMNA (0.91) LMNAPDE4ATDP1L3MBTL1USP2
Gluconic Acid SCHEMBL141069 0.98 LMNA (0.91) LMNAPDE4ATDP1L3MBTL1USP2
Gluconic Acid SCHEMBL3717039 0.98 LMNA (0.91) LMNAPDE4ATDP1L3MBTL1USP2
Gluconic Acid SCHEMBL6653232 0.98 LMNA (0.91) LMNAPDE4ATDP1L3MBTL1USP2
SCHEMBL6907170 0.95 LMNA (0.87) LMNAPDE4ATDP1L3MBTL1USP2
Lithium Ion SCHEMBL1458069 0.95 LMNA (0.87) LMNAPDE4ATDP1L3MBTL1USP2
Gluceptate Sodium SCHEMBL11234259 0.95 LMNA (0.95) LMNAPDE4ATDP1L3MBTL1USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116672360-B Composition of toltrazuril and iron glucoheptonate 重庆汉佩生物科技有限公司 2024-05-14 CN claimed
CN-116712455-B Composition of florfenicol and iron glucoheptonate 重庆汉佩生物科技有限公司 2024-04-05 CN claimed
CN-116726045-B Florarana composition 重庆汉佩生物科技有限公司 2024-03-19 CN claimed
CN-117695398-A Application of glucoheptylic anhydride iron in stable dispersion of water-insoluble medicine active ingredient as slow-release colloid material and composition 重庆汉佩生物科技有限公司 2024-03-15 CN claimed
CN-116808072-B Insect-resistant composition 重庆汉佩生物科技有限公司 2024-02-20 CN claimed
CN-116808072-A Insect-resistant composition 重庆汉佩生物科技有限公司 2023-09-29 CN claimed
CN-116726045-A Florarana composition 重庆汉佩生物科技有限公司 2023-09-12 CN claimed
CN-116712455-A Composition of florfenicol and iron glucoheptonate 重庆汉佩生物科技有限公司 2023-09-08 CN claimed
CN-116672360-A Composition of toltrazuril and iron glucoheptonate 重庆汉佩生物科技有限公司 2023-09-01 CN claimed
CN-113801176-B Preparation method and application of iron complex 天津市中升挑战生物科技有限公司 2023-08-18 CN claimed
CN-113197849-A Suspension injection containing iron glucoheptonate and ponazuril and preparation method thereof 湖北龙翔药业科技股份有限公司 2021-08-03 CN claimed
CN-112423762-A Formulation for the simultaneous treatment of coccidial infections and iron deficiency 拜耳动物保健有限责任公司 2021-02-26 CN claimed
CN-112165946-A Formulations containing triazineone and iron with small amounts of free iron ions 拜耳动物保健有限责任公司 2021-01-01 CN claimed
CN-106236709-B Glucoheptosylvine nano-emulsion and preparation method thereof 天津市中升挑战生物科技有限公司 2020-05-01 CN claimed
CN-110776416-A Preparation method of iron glucoheptonate 上海永通生态工程股份有限公司 2020-02-11 CN claimed
US-8536106-B2 Ferric hydroxycarboxylate as a builder ECOLAB USA INC. (US) 2013-09-17 US claimed
US-20110257071-A1 FERRIC HYDROXYCARBOXYLATE AS A BUILDER ECOLAB USA INC. (US) 2011-10-20 US claimed
US-6610325-B1 Tablets to be crunched or sucked, comprising iron as active principle LABORATOIRE INNOTHERA (FR) 2003-08-26 US claimed
WO-2002009518-A1 MOLLUSCICIDAL COMPOSITION YOUNG COLIN LESLIE (AU) 2002-02-07 WO claimed
EP-1052987-B1 TABLETS TO BE CRUNCHED OR SUCKED, COMPRISING IRON AS ACTIVE PRINCIPLE INNOTHERA SA LAB (FR) 2002-02-06 EP claimed