SCHEMBL7039700

SCHEMBL7039700

O=C(O)CC(O)(CO)CC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
HMGCR P04035 1/20 0.48
CHRM1 P11229 1/20 0.48
TBXA2R P21731 1/20 0.48
ADRA1A P35348 1/20 0.48
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
ACLY P53396 3/20 0.39
CPT2 P23786 2/20 0.37
KDM4E B2RXH2 1/20 0.35
FFAR1 O14842 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MVD P53602 1/20 0.32
LDHA P00338 1/20 0.32
SRR Q9GZT4 1/20 0.32

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
SCHEMBL880688 0.83 ALDH1A1 (0.56) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL29363039 0.80 ALDH1A1 (0.53) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL30017023 0.80 ALDH1A1 (0.53) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Water SCHEMBL29581041 0.78 ALDH1A1 (0.50) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
Ammonia Solution, Strong SCHEMBL29372545 0.78 ALDH1A1 (0.50) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL1935141 0.77 ALDH1A1 (0.43) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL10586751 0.75
SCHEMBL11811168 0.73
SCHEMBL10777495 0.73 ALDH1A1 (0.46) ALDH1A1HMGCRCHRM1TBXA2RADRA1A
SCHEMBL380759 0.73 HMGCR (0.52) ALDH1A1HMGCRCHRM1TBXA2RADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6783613-B1 HYDROXY FUNCTIONALIZED POLYBUTADIENE (HFPB) BASED BINDERS FOR ENERGETIC MATERIALS THAT POSSESS IMPROVED COMPATIBILITY WITH ENERGETIC PLASTICIZERS AND ARE CHEMICALLY DEGRADABLE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2004-08-31 US claimed
US-6436136-B1 Shaped bodies for use as implants in human medicine and method for the production of such shaped bodies ARTIMPLANT AB (SE) 2002-08-20 US claimed
EP-1027086-B1 SHAPED BODIES FOR USE AS IMPLANTS IN HUMAN MEDICINE AND METHOD FOR THE PRODUCTION OF SUCH SHAPED BODIES ARTIMPLANT AB (SE) 2002-04-17 EP claimed
EP-1027086-A1 SHAPED BODIES FOR USE AS IMPLANTS IN HUMAN MEDICINE AND METHOD FOR THE PRODUCTION OF SUCH SHAPED BODIES Artimplant AB (SE) 2000-08-16 EP claimed
WO-1999022780-A1 SHAPED BODIES FOR USE AS IMPLANTS IN HUMAN MEDICINE AND METHOD FOR THE PRODUCTION OF SUCH SHAPED BODIES ARTIMPLANT AB (SE) 1999-05-14 WO claimed
US-5292626-A Developer containing an O-carboxymethyl ethylene glycol compound HOECHST AKTIENGESELLSCHAFT (DE) 1994-03-08 US claimed
EP-4252758-A1 METHOD FOR TREATING PAIN BY VANADIUM COMPOUND Shenzhen Fangshengtai Medical Technology Co., Ltd. (CN) 2023-10-04 EP disclosed
US-9580385-B2 Carbondisulfide derived zwitterions TPAT IP LLC 2017-02-28 US disclosed
US-6783613-B1 HYDROXY FUNCTIONALIZED POLYBUTADIENE (HFPB) BASED BINDERS FOR ENERGETIC MATERIALS THAT POSSESS IMPROVED COMPATIBILITY WITH ENERGETIC PLASTICIZERS AND ARE CHEMICALLY DEGRADABLE THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2004-08-31 US disclosed
US-6436136-B1 Shaped bodies for use as implants in human medicine and method for the production of such shaped bodies ARTIMPLANT AB (SE) 2002-08-20 US disclosed
US-6395112-B1 POLYMER WITH ESTER AND ETHER GROUPS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY 2002-05-28 US disclosed
EP-1027086-B1 SHAPED BODIES FOR USE AS IMPLANTS IN HUMAN MEDICINE AND METHOD FOR THE PRODUCTION OF SUCH SHAPED BODIES ARTIMPLANT AB (SE) 2002-04-17 EP disclosed
US-6022865-A Stable aqueous solution having high concentrations of calcium and phosphate ions and solid complex UNIVERSITY OF CINCINNATI (US) 2000-02-08 US disclosed
US-4839066-A Fabric-softening detergent HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1989-06-13 US disclosed
US-4839075-A Fabric-softening detergent HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1989-06-13 US disclosed
US-4737306-A MIXED CRYSTAL SYSTEM KENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1988-04-12 US disclosed
EP-0198765-A2 Preparation of liposomes GEORGETOWN UNIVERSITY (US) 1986-10-22 EP disclosed
US-4171278-A WITH AN ANIONIC SULFATE OR SULFONATE OR A NONIONIC ETHOXYLATE TYPE SURFACTANT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1979-10-16 US disclosed
US-4169074-A Compositions for cold water washing containing N-substituted ω-hydroxyalkane carboxylic acid amides HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 1979-09-25 US disclosed
US-4150024-A Reaction products of epsilon-caprolactam with vicinal hydroxyalkylamines and alkoxylation products thereof HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1979-04-17 US disclosed