SCHEMBL6998418

SCHEMBL6998418

CC[C@@H](OC)n1cc(C)c(=O)[nH]c1=O

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.43
HPGD P15428 1/20 0.42
TK1 P04183 1/20 0.40
TYMP P19971 4/20 0.39
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
ALB P02768 1/20 0.38
POLB P06746 1/20 0.38
ADRA1A P35348 1/20 0.38
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL10474572 0.84 TYMP (0.42) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL22047282 0.83 CYP1A2 (0.41) TK1TYMPALDH1A1BLMSMN1; SMN2
SCHEMBL17899463 0.83 SMN1; SMN2 (0.55) HPGDALDH1A1LMNAPOLBSMN1; SMN2
SCHEMBL15948684 0.80 TYMP (0.42) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL22398916 0.80 MAPK1 (0.44) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL16038197 0.79 TYMP (0.60) MAPK1HPGDTK1TYMP
SCHEMBL22381003 0.78 ALDH1A1 (0.43) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL6153438 0.78 MAPK1 (0.42) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL19662195 0.77 ALDH1A1 (0.42) MAPK1HPGDTK1TYMPALDH1A1
SCHEMBL12646693 0.76 SMN1; SMN2 (0.40) MAPK1HPGDTK1TYMPALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230130194-A1 TRANSGLUTAMINASE-MEDIATED CONJUGATION HORIZON TECHNOLOGY FINANCE CORPORATION 2023-04-27 US disclosed
US-20220411860-A1 DESIGN AND SYNTHESIS OF NOVEL DISULFIDE LINKER BASED NUCLEOTIDES AS REVERSIBLE TERMINATORS FOR DNA SEQUENCING BY SYNTHESIS THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2022-12-29 US disclosed
US-20210381040-A1 METHODS FOR CHEMICAL LIGATION OF NUCLEIC ACIDS ILLUMINA, INC. 2021-12-09 US disclosed
US-20200190515-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF WAVE LIFE SCIENCES LTD. (SG) 2020-06-18 US disclosed
US-10363266-B2 Antisense-oligonucleotides as inhibitors of TGF-R signaling Neurovision Pharma GmbH (DE) 2019-07-30 US disclosed
US-9701962-B2 Hydrophobically modified antisense oligonucleotides comprising a ketal group INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2017-07-11 US disclosed
US-8183355-B2 Method for the synthesis of oligonucleotide derivatives CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2012-05-22 US disclosed
US-20110245478-A1 Method for the Synthesis of Oligonucleotide Derivatives CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) 2011-10-06 US disclosed
US-20110082288-A1 PURIFICATION OF SYNTHETIC OLIGOMERS MICHIGAN TECHNOLOGICAL UNIVERSITY (US) 2011-04-07 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 (6 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-20200190515-A1 OLIGONUCLEOTIDE COMPOSITIONS AND METHODS OF USE THEREOF RNASE1, RNASEH1, RNASEL MAPK1 4496/4885HPGD 4570/4885TK1 474/4885
US-20220411860-A1 DESIGN AND SYNTHESIS OF NOVEL DISULFIDE LINKER BASED NUCLEOTIDES AS REVERSIBLE TERMINATORS FOR DNA SEQUENCING BY SYNTHESIS POLL, POLQ, POLB MAPK1 3556/4885HPGD 522/4885TK1 54/4885
US-20110082288-A1 PURIFICATION OF SYNTHETIC OLIGOMERS RNGTT, NOP2, CAPZA2 MAPK1 4672/4885HPGD 3815/4885TK1 1545/4885
US-20110245478-A1 Method for the Synthesis of Oligonucleotide Derivatives MSN, RNGTT, DCLRE1B MAPK1 3443/4885HPGD 4318/4885TK1 56/4885
US-10363266-B2 Antisense-oligonucleotides as inhibitors of TGF-R signaling TGFBR1, TGFBR2, TGFB1 MAPK1 181/4885HPGD 4222/4885TK1 89/4885
US-20230130194-A1 TRANSGLUTAMINASE-MEDIATED CONJUGATION TGM2, TGM3, TGM1 MAPK1 4783/4885HPGD 2300/4885TK1 310/4885

“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.