SCHEMBL6764272

SCHEMBL6764272

O=CN[C@H]1CC(=O)OC1=O

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 1/20 0.33
ADH1B P00325 3/20 0.32
ADH1A P07327 3/20 0.32
ALDH1A1 P00352 1/20 0.30
TSHR P16473 1/20 0.30
ADH1C P00326 2/20 0.30
ADH7 P40394 2/20 0.30

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
SCHEMBL2403213 1.00 CTRB1 (0.33) CTRB1ADH1BADH1AALDH1A1TSHR
SCHEMBL10816103 0.81 CTRB1 (0.35) CTRB1
SCHEMBL17074053 0.79 ADH1B (0.34) CTRB1ADH1BADH1ATSHRADH1C
SCHEMBL11126612 0.74 CTRB1 (0.31) CTRB1
SCHEMBL16142754 0.73
SCHEMBL9060305 0.73
SCHEMBL14867596 0.73
SCHEMBL11795515 0.69 ALOX15 (0.36)
SCHEMBL7191306 0.68 ALDH1A1 (0.30) ALDH1A1TSHR
SCHEMBL8634789 0.68 CTRB1 (0.35) CTRB1

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114106090-B Production process of aspartame 江苏汉光生物工程有限公司 2024-03-19 CN disclosed
CN-114106090-A Production process of aspartame 江苏汉光生物工程有限公司 2022-03-01 CN disclosed
US-8431612-B2 Ester prodrugs of prostratin and related phorbol compounds SALVIA SCIENCES, INC. (US) 2013-04-30 US disclosed
US-8431612-B2 Ester prodrugs of prostratin and related phorbol compounds SALVIA SCIENCES, INC. (US) 2013-04-30 US disclosed
US-20090163587-A1 ESTER PRODRUGS OF PROSTRATIN AND RELATED PHORBOL COMPOUNDS SALVIA SCIENCES, INC. (US) 2009-06-25 US disclosed
US-20090163587-A1 ESTER PRODRUGS OF PROSTRATIN AND RELATED PHORBOL COMPOUNDS SALVIA SCIENCES, INC. (US) 2009-06-25 US disclosed
US-6730289-B2 HAIR STYLING MIXTURE COMPRISING AN ACYLATED CARBAMATE GROUP MODIFIED POLYURETHANE AND ACCEPTABLE CARRIER OR DILUENT; NO DEPOSITS ON HAIR, WATER SOLUBLE UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2004-05-04 US disclosed
US-20020176837-A1 Cosmetic composition UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. 2002-11-28 US disclosed
US-6437145-B1 REACTING N-PROTECTED AMINODICARBOXYLIC ACIDS WITH A DEHYDRATING AGENT TO FORM CYCLIC ANHYDRIDES WHICH ARE REACTED WITH CARBONYL COMPOUNDS; FOR THE ALPHA-SELECTIVE PRODUCTION OF ESTERS OR AMIDES OF DICARBOXYLIC AMINO ACIDS DEGUSSA-HULS AG (DE) 2002-08-20 US disclosed
WO-2002058645-A1 POLYURETHANES, COSMETIC COMPOSITIONS CONTAINING THEM AND METHOD OF PREPARATION UNILEVER PLC (GB) 2002-08-01 WO disclosed
US-6051715-A Method of producing oxazolidinones, the use thereof and novel oxazolidinones DEGUSSA-HULS AG (DE) 2000-04-18 US disclosed
EP-0468063-B1 A one-pot process for the preparation of alpha-L-aspartyl-L-phenylalanine methyl ester hydrochloride NUTRASWEET CO (US) 1996-06-05 EP disclosed
EP-0466959-B1 Process for the preparation of n-formyl-l-aspartic anhydride NUTRASWEET CO (US) 1996-01-17 EP disclosed
US-5476961-A Formylating L-aspartic acid, coupling with L-phenylalanine in the presence of acetic acid, deformylating, removing acid residues, esterifying, forming salt THE NUTRASWEET COMPANY (US) 1995-12-19 US disclosed
EP-0468063-A1 A one-pot process for the preparation of alpha-L-aspartyl-L-phenylalanine methyl ester hydrochloride THE NUTRASWEET COMPANY (US) 1992-01-29 EP disclosed
WO-1992000953-A1 A ONE-POT PROCESS FOR THE PREPARATION OF ALPHA-L-ASPARTYL-L-PHENYLALANINE METHYL ESTER HYDROCHLORIDE THE NUTRASWEET COMPANY (US) 1992-01-23 WO disclosed
EP-0466959-A1 Process for the preparation of n-formyl-l-aspartic anhydride THE NUTRASWEET COMPANY (US) 1992-01-22 EP disclosed
US-5053532-A Agitating N-formyl-L-aspartic anhydride with L-phenylalanine in presence of acid, alcohol, alkyl ester THE NUTRA SWEET COMPANY (US) 1991-10-01 US disclosed
US-4760164-A Coupling formyl-L-aspartic anhydride with L-phenylalanine esterification, netralization and filtration KOREA GREEN CROSS CORPORATION (KR) 1988-07-26 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 (2 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-20090163587-A1 ESTER PRODRUGS OF PROSTRATIN AND RELATED PHORBOL COMPOUNDS PMAIP1, PTGIR, PTGDR CTRB1 2632/4885ADH1B 2298/4885ADH1A 1643/4885
US-20020176837-A1 Cosmetic composition POLR1C, ALKBH5, HAT1 CTRB1 2640/4885ADH1B 3167/4885ADH1A 3063/4885

“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.