SCHEMBL9316609

SCHEMBL9316609

Cc1oc(-c2ccccc2)nc1CN(C)C(=O)c1ccc(C=O)cc1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.52
TP53 P04637 1/20 0.52
THRB P10828 1/20 0.52
KDM4E B2RXH2 3/20 0.52
HPGD P15428 1/20 0.46
RAB9A P51151 4/20 0.46
NPC1 O15118 3/20 0.46
PPARG P37231 9/20 0.46
PPARA Q07869 9/20 0.46
MEN1 O00255 1/20 0.43
HSP90AA1 P07900 1/20 0.43
KMT2A Q03164 1/20 0.43
PPARD Q03181 1/20 0.43
HRH1 P35367 1/20 0.42
CES2 O00748 1/20 0.42
HRH3 Q9Y5N1 1/20 0.42

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
SCHEMBL10480739 0.89 KDM4E (0.50) LMNATP53THRBKDM4EHPGD
SCHEMBL10480768 0.83 ACACB (0.41) LMNATP53THRBHPGDMEN1
SCHEMBL9316506 0.82 LMNA (0.47) LMNATP53THRBKDM4EHPGD
SCHEMBL9316424 0.81 KDM4E (0.43) LMNATP53THRBKDM4EHPGD
SCHEMBL5795341 0.80 KDM4E (0.54) KDM4EHPGDPPARGPPARAPPARD
SCHEMBL10480772 0.79 KDM4E (0.53) KDM4EHPGDPPARGPPARAPPARD
SCHEMBL9316421 0.79 MAPT (0.59) LMNATP53THRBKDM4E
SCHEMBL10480771 0.78 KDM4E (0.52) KDM4EHPGDPPARGPPARAPPARD
SCHEMBL9316606 0.77 POLB (0.55) TP53THRBKDM4EPPARGPPARA
SCHEMBL10480741 0.77 KDM4E (0.40) LMNATP53THRBKDM4EHPGD

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
US-5330998-A Anticholesterol agents PFIZER INC. (US) 1994-07-19 US disclosed
EP-0389699-B1 Thiazolidinedione derivatives as hypoglycemic agents PFIZER (US) 1994-05-11 EP disclosed
EP-0389699-A1 Thiazolidinedione derivatives as hypoglycemic agents PFIZER INC. (US) 1990-10-03 EP disclosed