SCHEMBL559624

SCHEMBL559624

O=C(O)C(=O)CC(O)(Cc1ccccc1)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.48
HIF1A Q16665 1/20 0.48
FDPS P14324 1/20 0.43
CYP2C9 P11712 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
CES1 P23141 2/20 0.42
CES2 O00748 1/20 0.42
SLC13A5 Q86YT5 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP3A4 P08684 2/20 0.39
ALDH1A1 P00352 2/20 0.39
MMP8 P22894 1/20 0.38
AKR1B1 P15121 1/20 0.38
ERCC5 P28715 2/20 0.37
FEN1 P39748 2/20 0.37

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
SCHEMBL7300860 0.85 SLC13A5 (0.56) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL419615 0.84 SMN1; SMN2 (0.59) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL10941763 0.83 SLC13A5 (0.54) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL9554595 0.81 SMN1; SMN2 (0.53) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL9554586 0.81 SMN1; SMN2 (0.53) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL559795 0.80 CTBP2 (0.54) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL559796 0.80 CTBP2 (0.54) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL3730337 0.79 SMN1; SMN2 (0.53) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL10029379 0.77 SMN1; SMN2 (0.44) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2
SCHEMBL10029155 0.77 SMN1; SMN2 (0.52) SMN1; SMN2HIF1AFDPSCYP2C9CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7868187-B2 Processes of producing glutamic acid compounds and production intermediates therefore and novel intermediate for the processes AJINOMOTO CO., INC. (JP) 2011-01-11 US claimed
US-20090259052-A1 PROCESSES OF PRODUCING GLUTAMIC ACID COMPOUNDS AND PRODUCTION INTERMEDIATES THEREFORE AND NOVEL INTERMEDIATE FOR THE PROCESSES AJINOMOTO CO. INC (JP) 2009-10-15 US claimed
US-7432100-B2 Variant aldolase and processes for producing an optically active IHOG and an optically active monatin using the same AJINOMOTO CO., INC. (JP) 2008-10-07 US claimed
US-20050244939-A1 Variant aldolase and processes for producing an optically active IHOG and an optically active monatin using the same AJINOMOTO CO., INC. (JP) 2005-11-03 US claimed
US-20050153405-A1 Novel aldolase and production process of substituted alpha-keto acids AJINOMOTO CO., INC. (JP) 2005-07-14 US claimed
EP-1533376-A1 NOVEL ALDOLASES AND PROCESS FOR PRODUCING SUBSTITUTED ALPHA-KETO ACID Ajinomoto Co., Inc. (JP) 2005-05-25 EP claimed
US-8697416-B2 Recombinant polynucleotide, host cells containing the same and a process for producing a protein having aldolase activity AJINOMOTO CO., INC. (JP) 2014-04-15 US disclosed
US-8669080-B2 Mutated D-aminotransferase and method for producing optically active glutamic acid derivatives using the same AJINOMOTO CO., INC. (JP) 2014-03-11 US disclosed
US-8563278-B2 Process of producing glutamate derivatives AJINOMOTO CO., INC. (JP) 2013-10-22 US disclosed
US-8563278-B2 Process of producing glutamate derivatives AJINOMOTO CO., INC. (JP) 2013-10-22 US disclosed
US-8563278-B2 Process of producing glutamate derivatives AJINOMOTO CO., INC. (JP) 2013-10-22 US disclosed
EP-1580268-B1 MUTANT D-AMINOTRANSFERASE AND PROCESS FOR PRODUCING OPTICALLY ACTIVE GLUTAMIC ACID DERIVATIVE USING THE SAME AJINOMOTO KK (JP) 2013-10-02 EP disclosed
US-20130252310-A1 NOVEL ALDOLASE AND PRODUCTION PROCESS OF SUBSTITUTED ALPHA-KETO ACIDS AJINOMOTO, CO., INC. (JP) 2013-09-26 US disclosed
US-20050153405-A1 Novel aldolase and production process of substituted alpha-keto acids AJINOMOTO CO., INC. (JP) 2005-07-14 US disclosed
EP-1533376-A1 NOVEL ALDOLASES AND PROCESS FOR PRODUCING SUBSTITUTED ALPHA-KETO ACID Ajinomoto Co., Inc. (JP) 2005-05-25 EP disclosed
CN-1610658-A Process for producing glutamic acid compound and intermediate for producing the same, and novel intermediate for use therein AJINOMOTO KK (JP) 2005-04-27 CN disclosed
US-20050009153-A1 Such as 3-indolepyruvic acid by exposing tryptophan to amino acid oxidase/catalase, adjusting pH with sulfuric acid, then deaerating/deoxygenating AJINOMOTO CO., INC. (JP) 2005-01-13 US disclosed
US-20050004394-A1 Processes of producing glutamic acid compounds and production intermediates therefore and novel intermediate for the processes AJINOMOTO CO. IN (JP) 2005-01-06 US disclosed
EP-1466890-A1 PROCESSES FOR THE PREPARATION OF GLUTAMIC ACID COMPOUNDS AND INTERMEDIATES THEREOF AND NOVEL INTERMEDIATES USED IN THE PROCESSES Ajinomoto Co., Inc. (JP) 2004-10-13 EP disclosed
EP-1445323-A1 PROCESS FOR PRODUCTION OF GLUTAMIC ACID DERIVATIVES Ajinomoto Co., Inc. (JP) 2004-08-11 EP 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-20050004394-A1 Processes of producing glutamic acid compounds and production intermediates therefore and novel intermediate for the processes GLUL, MON2, GRIK5 SMN1; SMN2 2414/4885HIF1A 4218/4885FDPS 382/4885
US-20050244939-A1 Variant aldolase and processes for producing an optically active IHOG and an optically active monatin using the same ALDOA, MON2, HOGA1 SMN1; SMN2 2260/4885HIF1A 2150/4885FDPS 927/4885
US-20090259052-A1 PROCESSES OF PRODUCING GLUTAMIC ACID COMPOUNDS AND PRODUCTION INTERMEDIATES THEREFORE AND NOVEL INTERMEDIATE FOR THE PROCESSES GLUL, MON2, GRIK5 SMN1; SMN2 2414/4885HIF1A 4218/4885FDPS 382/4885

“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.