SCHEMBL15512657

SCHEMBL15512657

Cc1cc(-c2nc3ccccc3c(=O)n2-c2ccc(C(=O)O)cc2)cc(C)c1OCCO

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.57
ALDH1A1 P00352 5/20 0.50
POLB P06746 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
TSHR P16473 1/20 0.48
RAB9A P51151 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
GFER P55789 1/20 0.47
KCNH2 Q12809 1/20 0.46
HRH3 Q9Y5N1 1/20 0.46
BLM P54132 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MAPT P10636 1/20 0.46

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
SCHEMBL2559006 0.91 POLB (0.61) MAPK1ALDH1A1POLBMEN1KMT2A
SCHEMBL2562815 0.89 ALDH1A1 (0.51) MAPK1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL2561941 0.89 ALDH1A1 (0.51) MAPK1ALDH1A1POLBMEN1KMT2A
SCHEMBL2565658 0.89 SMN1; SMN2 (0.52) ALDH1A1MEN1KMT2ARAB9ANPSR1
SCHEMBL2566454 0.89 ALDH1A1 (0.51) MAPK1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL2564148 0.89 ALDH1A1 (0.51) MAPK1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL2565762 0.87 ALDH1A1 (0.49) MAPK1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL2562976 0.87 ALDH1A1 (0.49) MAPK1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL2567691 0.87 ALDH1A1 (0.49) MAPK1ALDH1A1MEN1KMT2ARAB9A
SCHEMBL2562510 0.87 ALDH1A1 (0.49) MAPK1ALDH1A1MEN1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2382194-B1 COMPOUNDS FOR THE PREVENTION AND TREATMENT OF CARDIOVASCULAR DISEASE RESVERLOGIX CORP (CA) 2014-03-12 EP claimed