SCHEMBL331768

SCHEMBL331768

NC(=O)OC[C@H]1O[C@@H](n2ccc(N)nc2=O)[C@H](O)[C@@H]1O

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.70
THRB P10828 1/20 0.70
MTOR P42345 1/20 0.70
MDM2 Q00987 1/20 0.70
NCOA1 Q15788 1/20 0.70
NCOA3 Q9Y6Q9 1/20 0.70
L3MBTL1 Q9Y468 1/20 0.58
TSHR P16473 1/20 0.57
GLA P06280 1/20 0.57
P2RY2 P41231 1/20 0.57
ST6GAL1 P15907 6/20 0.55
NT5E P21589 1/20 0.53

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
SCHEMBL30608768 0.91 LMNA (0.74) LMNATHRBMTORMDM2NCOA1
SCHEMBL6060610 0.90 LMNA (0.69) LMNATHRBMTORMDM2NCOA1
SCHEMBL236108 0.90 LMNA (0.69) LMNATHRBMTORMDM2NCOA1
Hydrochloric Acid SCHEMBL11852751 0.89 LMNA (0.67) LMNATHRBMTORMDM2NCOA1
SCHEMBL24680959 0.88 LMNA (0.66) LMNATHRBMTORMDM2NCOA1
SCHEMBL441997 0.88 LMNA (0.66) LMNATHRBMTORMDM2NCOA1
SCHEMBL13678671 0.88 LMNA (0.66) LMNATHRBMTORMDM2NCOA1
SCHEMBL15197971 0.88 LMNA (0.66) LMNATHRBMTORMDM2NCOA1
SCHEMBL5491562 0.87 LMNA (0.75) LMNATHRBMTORMDM2NCOA1
SCHEMBL4946508 0.87 LMNA (0.75) LMNATHRBMTORMDM2NCOA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097706-B2 Methods for preparing capecitabine and beta-anomer-rich trialkyl carbonate compound used therein Hammi Holdings Co., Ltd (KR) 2012-01-17 US claimed
US-20100249395-A1 METHODS FOR PREPARING CAPECITABINE AND BETA-ANOMER-RICH TRIALKYL CARBONATE COMPOUND USED THEREIN HANMI PHARM. CO., LTD. (KR) 2010-09-30 US claimed
EP-2220090-A1 METHODS FOR PREPARING CAPECITABINE AND BETA-ANOMER-RICH TRIALKYL CARBONATE COMPOUND USED THEREIN Hanmi Pharm. Co., Ltd. (KR) 2010-08-25 EP claimed
WO-2009066892-A1 METHODS FOR PREPARING CAPECITABINE AND BETA-ANOMER-RICH TRIALKYL CARBONATE COMPOUND USED THEREIN HANMI PHARM. CO., LTD. (KR) 2009-05-28 WO claimed
US-20240158833-A1 Compositions and Methods for Labeling Modified Nucleotides in Nucleic Acids NEW ENGLAND BIOLABS, INC. (US) 2024-05-16 US disclosed
EP-4294936-A1 COMPOSITIONS AND METHODS FOR LABELING MODIFIED NUCLEOTIDES IN NUCLEIC ACIDS New England Biolabs, Inc. (US) 2023-12-27 EP disclosed
WO-2022178093-A1 COMPOSITIONS AND METHODS FOR LABELING MODIFIED NUCLEOTIDES IN NUCLEIC ACIDS NEW ENGLAND BIOLABS, INC. (US) 2022-08-25 WO disclosed
US-8097706-B2 Methods for preparing capecitabine and beta-anomer-rich trialkyl carbonate compound used therein Hammi Holdings Co., Ltd (KR) 2012-01-17 US disclosed
US-20100249395-A1 METHODS FOR PREPARING CAPECITABINE AND BETA-ANOMER-RICH TRIALKYL CARBONATE COMPOUND USED THEREIN HANMI PHARM. CO., LTD. (KR) 2010-09-30 US disclosed
EP-2220090-A1 METHODS FOR PREPARING CAPECITABINE AND BETA-ANOMER-RICH TRIALKYL CARBONATE COMPOUND USED THEREIN Hanmi Pharm. Co., Ltd. (KR) 2010-08-25 EP disclosed
WO-2009066892-A1 METHODS FOR PREPARING CAPECITABINE AND BETA-ANOMER-RICH TRIALKYL CARBONATE COMPOUND USED THEREIN HANMI PHARM. CO., LTD. (KR) 2009-05-28 WO disclosed
EP-1140967-A1 TARGETED GENE TRANSFER USING G PROTEIN COUPLED RECEPTORS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2001-10-10 EP disclosed
WO-2000039145-A1 TARGETED GENE TRANSFER USING G PROTEIN COUPLED RECEPTORS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2000-07-06 WO 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 (1 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-20100249395-A1 METHODS FOR PREPARING CAPECITABINE AND BETA-ANOMER-RICH TRIALKYL CARBONATE COMPOUND USED THEREIN TYMP, SI, DPYD LMNA 3050/4885THRB 4265/4885MTOR 816/4885

“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.