SCHEMBL9153202

SCHEMBL9153202

COC(C)(C)CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.50
PTGS1 P23219 2/20 0.50
PTGS2 P35354 2/20 0.50
LMNA P02545 1/20 0.49
RECQL P46063 1/20 0.49
CA2 P00918 3/20 0.46
CA1 P00915 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.42
NPSR1 Q6W5P4 1/20 0.42
F2R P25116 3/20 0.42
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
HTT P42858 1/20 0.41
POLB P06746 1/20 0.41
TYR P14679 1/20 0.41

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
SCHEMBL9154003 0.81 ALOX5 (0.54) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL9156265 0.79 ALOX5 (0.53) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL8766229 0.79 ALOX5 (0.56) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL9156253 0.79 ALOX5 (0.53) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL724655 0.78 PTGS1 (0.51) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL11618543 0.77 PTGS2 (0.62) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL1928189 0.77 LMNA (0.61) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL9774992 0.77 PTGS1 (0.57) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL9156294 0.77 LMNA (0.53) ALOX5PTGS1PTGS2LMNARECQL
SCHEMBL7700940 0.75 ALOX5 (0.60) 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
US-5476876-A Analgesics THE PROCTER & GAMBLE COMPANY (US) 1995-12-19 US disclosed