SCHEMBL640184

SCHEMBL640184

NO[C@@H](C=O)[C@H](O)[C@H](O)CO

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TDP1 Q9NUW8 1/20 0.40
USP2 O75604 1/20 0.38
SLCO1B1 Q9Y6L6 1/20 0.38
AKR1B1 P15121 1/20 0.37
PDE4A P27815 1/20 0.35
KDM4E B2RXH2 2/20 0.31

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
SCHEMBL11424155 1.00 LMNA (0.42) LMNAL3MBTL1TDP1USP2SLCO1B1
SCHEMBL122818 1.00 LMNA (0.42) LMNAL3MBTL1TDP1USP2SLCO1B1
SCHEMBL319408 0.94 LMNA (0.46) LMNAL3MBTL1TDP1USP2SLCO1B1
SCHEMBL3073599 0.94 LMNA (0.46) LMNAL3MBTL1TDP1USP2SLCO1B1
SCHEMBL2635052 0.94 LMNA (0.46) LMNAL3MBTL1TDP1USP2SLCO1B1
SCHEMBL517269 0.94 LMNA (0.46) LMNAL3MBTL1TDP1USP2SLCO1B1
Hydrochloric Acid SCHEMBL8587068 0.92 LMNA (0.44) LMNAL3MBTL1TDP1USP2SLCO1B1
SCHEMBL10534255 0.88 LMNA (0.41) LMNAL3MBTL1TDP1USP2SLCO1B1
Phosphoric Acid SCHEMBL5789520 0.87 LMNA (0.39) LMNAL3MBTL1TDP1USP2SLCO1B1
Acetic Acid SCHEMBL7951061 0.87 USP2 (0.44) LMNAL3MBTL1TDP1USP2SLCO1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8119364-B2 Methods for generating analogs of coenzyme A THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2012-02-21 US disclosed
US-20100304430-A1 Methods for Generating Analogs of Coenzyme A THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-12-02 US disclosed
US-7727738-B2 Methods for generating analogs of coenzyme A THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2010-06-01 US disclosed
US-20070128683-A1 Metabolic delivery of coenzyme A analogs NATIONAL SCIENCE FOUNDATION 2007-06-07 US disclosed