SCHEMBL18083571

SCHEMBL18083571

CC(C)(C)c1cc(C(=O)CC(N)=O)cc(C(C)(C)C)c1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.53
PTGS1 P23219 2/20 0.53
PTGS2 P35354 2/20 0.53
LMNA P02545 1/20 0.51
RECQL P46063 1/20 0.51
GAA P10253 3/20 0.51
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 3/20 0.47
TDP1 Q9NUW8 1/20 0.47
CA2 P00918 2/20 0.45
CA1 P00915 1/20 0.45
F2R P25116 2/20 0.45
SMN1; SMN2 Q16637 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
MAOB P27338 1/20 0.44
POLB P06746 1/20 0.44
TYR P14679 1/20 0.44
KDM4E B2RXH2 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL9282683 0.86 GAA (0.60) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL9292476 0.84 ALOX5 (0.59) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL1708401 0.81 GAA (0.58) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL10786189 0.81 ALOX5 (0.55) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL724655 0.81 PTGS1 (0.51) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL722951 0.81 GAA (0.54) ALOX5PTGS1PTGS2LMNARECQL
Hydrochloric Acid SCHEMBL10786981 0.80 ALOX5 (0.54) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL1928189 0.79 LMNA (0.61) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL47590 0.79 LMNA (0.55) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL2481839 0.78 ALOX5 (0.55) ALOX5PTGS1PTGS2LMNARECQL

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-2751084-B1 PYRIMIDINE CARBOXAMIDE DERIVATIVES EUDIS BIOTECH LLC (CN) 2016-09-21 EP disclosed