SCHEMBL1197330

SCHEMBL1197330

CO[C@H](C(=O)O)[C@H](OC)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.65
SLC1A2 P43004 1/20 0.65
SLC1A1 P43005 1/20 0.65
TP53 P04637 2/20 0.39
MMP1 P03956 1/20 0.37
MMP2 P08253 1/20 0.37
MMP3 P08254 1/20 0.37
MMP9 P14780 1/20 0.37
MMP13 P45452 1/20 0.37
ALDH1A1 P00352 3/20 0.33
TSHR P16473 2/20 0.33
KMT2A Q03164 2/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
RECQL P46063 1/20 0.33
SLC7A5 Q01650 1/20 0.32
ABCB11 O95342 1/20 0.32
F2 P00734 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 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
SCHEMBL1196043 1.00 SLC1A3 (0.65) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL10591110 1.00 SLC1A3 (0.65) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL606620 1.00 SLC1A3 (0.65) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL9885923 0.86 SLC1A3 (0.52) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL2878257 0.86 SLC1A3 (0.52) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL13304410 0.84 SLC1A3 (0.56) SLC1A3SLC1A2SLC1A1TP53MMP1
SCHEMBL1085084 0.84
SCHEMBL466551 0.84
SCHEMBL15114574 0.84
SCHEMBL6548114 0.84 SLC1A3 (0.50) SLC1A3SLC1A2SLC1A1MMP1MMP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0693704-B1 Semi-organic crystals for nonlinear optical devices ROCKWELL INTERNATIONAL CORP (US) 2002-08-28 EP claimed
EP-3976692-A1 AQUEOUS DISPERSIONS OF PRE-CROSSLINKED ORGANOPOLYSILOXANES Wacker Chemie AG (DE) 2022-04-06 EP disclosed
WO-2020239229-A1 AQUEOUS DISPERSIONS OF PRE-CROSSLINKED ORGANOPOLYSILOXANES WACKER CHEMIE AG (DE) 2020-12-03 WO disclosed
US-20170342027-A1 CHIRAL RESOLUTION METHOD OF N-[4-(1-AMINOETHYL)-PHENYL]-SULFONAMIDE DERIVATIVES AMOREPACIFIC CORPORATION (KR) 2017-11-30 US disclosed
US-9782746-B2 Polymeric ionic liquids, methods of making and methods of use thereof THE UNIVERSITY OF TOLEDO (US) 2017-10-10 US disclosed
US-20160114309-A1 Polymeric Ionic Liquids, Methods of Making and Methods of Use Thereof THE UNIVERSITY OF TOLEDO (US) 2016-04-28 US disclosed
US-9249261-B2 Polymeric ionic liquids, methods of making and methods of use thereof THE UNIVERSITY OF TOLEDO (US) 2016-02-02 US disclosed
US-8956445-B2 High stability diionic liquid salts SIGMA-ALDRICH CO. (US) 2015-02-17 US disclosed
US-8759583-B2 Process for enantioselective synthesis of single enantiomers of modafinil by asymmetric oxidation TEVA SANTE (FR) 2014-06-24 US disclosed
US-8734673-B2 Boron selective ionic liquids and polymeric ionic liquids, methods of making and methods of use thereof THE UNIVERSITY OF TOLEDO (US) 2014-05-27 US disclosed
US-20050222257-A1 Process for enantioselective synthesis of single enantiomers of modafinil by asymmetric oxidation CEPHALON, INC. (US) 2005-10-06 US disclosed
US-20050080256-A1 Process for enantioselective synthesis of single enantiomers of modafinil by asymmetric oxidation TEVA SANTE (FR) 2005-04-14 US disclosed
WO-2005028428-A1 PROCESS FOR ENANTIOSELECTIVE SYNTHESIS OF SINGLE ENANTIOMERS OF MODAFINIL BY ASYMMETRIC OXIDATION CEPHALON FRANCE (FR) 2005-03-31 WO disclosed
EP-1516869-A1 Process for enantioselective synthesis of single enantiomers of modafinil by asymmetric oxidation CEPHALON FRANCE (FR) 2005-03-23 EP disclosed
US-5581010-A Semi-organic crystals for nonlinear optical devices ROCKWELL INTERNATIONAL CORPORATION (US) 1996-12-03 US disclosed
US-5510470-A CONTAINS A DIDEOXYSACCHARIDE; USED WITH ZERO VALENT NICKEL AS A CATALYST FOR ENANTIOSELECTIVE HYDROCYANATION E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-04-23 US disclosed
US-5484902-A HYDROCYANATION OF VINYL AROMATICS E. I. DU PONT DE NEMOURS AND COMPANY (US) 1996-01-16 US disclosed
US-5312957-A 2-/6-Methoxy-2-naphthalene/propionitrile E. I. DU PONT DE NEMOURS AND COMPANY (US) 1994-05-17 US disclosed
US-5175335-A Reacting vinyl aryl compounds with a source of hydrocyanic acid in presence of nickle zero valent compound and nonracemic bidentate organophosphorus ligand E. I. DU PONT DE NEMOURS AND COMPANY (US) 1992-12-29 US disclosed
US-4942227-A ANTITUMOR AGENTS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 1990-07-17 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 (3 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-20050222257-A1 Process for enantioselective synthesis of single enantiomers of modafinil by asymmetric oxidation CYP2F1, SULT1A1, SULT2A1 SLC1A3 1079/4885SLC1A2 497/4885SLC1A1 756/4885
US-20170342027-A1 CHIRAL RESOLUTION METHOD OF N-[4-(1-AMINOETHYL)-PHENYL]-SULFONAMIDE DERIVATIVES DHCR24, SRR, ACMSD SLC1A3 2297/4885SLC1A2 1546/4885SLC1A1 1796/4885
US-20050080256-A1 Process for enantioselective synthesis of single enantiomers of modafinil by asymmetric oxidation MAOA, CYP2F1, MAOB SLC1A3 1115/4885SLC1A2 493/4885SLC1A1 864/4885

“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.