SCHEMBL4436039

SCHEMBL4436039

O=CC[C@H](O)[C@H](O)CO.[O]

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 1/20 0.39
LMNA P02545 2/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
TDP1 Q9NUW8 1/20 0.36
PDE4A P27815 1/20 0.32
USP2 O75604 1/20 0.30
SLCO1B1 Q9Y6L6 1/20 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
SCHEMBL477499 0.97
SCHEMBL13062482 0.97
SCHEMBL1198324 0.97
SCHEMBL574324 0.97
SCHEMBL6272445 0.97 AKR1B1 (0.41) AKR1B1LMNAL3MBTL1TDP1PDE4A
SCHEMBL97624 0.97
SCHEMBL37362 0.97
SCHEMBL22720619 0.97 AKR1B1 (0.41) AKR1B1LMNAL3MBTL1TDP1PDE4A
SCHEMBL22720618 0.97 AKR1B1 (0.41) AKR1B1LMNAL3MBTL1TDP1PDE4A
Charcoal, Activated SCHEMBL6447300 0.94 AKR1B1 (0.39) AKR1B1LMNAL3MBTL1TDP1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2021506-A2 USE OF PRODUCTS OF PCR AMPLIFICATION CARRYING ELEMENTS OF SECONDARY STRUCTURE TO IMPROVE PCR-BASED NUCLEIC ACID DETECTION Kutyavin, Igor (US) 2009-02-11 EP disclosed
WO-2007127999-A2 USE OF PRODUCTS OF PCR AMPLIFICATION CARRYING ELEMENTS OF SECONDARY STRUCTURE TO IMPROVE PCR-BASED NUCLEIC ACID DETECTION KUTYAVIN IGOR (US) 2007-11-08 WO disclosed
US-5808038-A ANTICARCER AGENT THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1998-09-15 US disclosed