SCHEMBL6423841

SCHEMBL6423841

Cc1c(C=O)cc(-c2ccccc2)c(OCc2ccccc2)c1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 3/20 0.41
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
GSTP1 P09211 2/20 0.38
GAA P10253 2/20 0.38
MGAM O43451 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
MAPT P10636 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
AR P10275 1/20 0.36
BACE1 P56817 1/20 0.36
LMNA P02545 2/20 0.36
POLB P06746 1/20 0.36
PTPN1 P18031 1/20 0.36
HPGD P15428 1/20 0.35

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
SCHEMBL6423613 0.78 HPGD (0.49) PDCD1CD274GAAMGAMSI
SCHEMBL25877526 0.73 PTPN1 (0.48) ERN1GAAMAOAMAOBMAPT
SCHEMBL25877949 0.73 PTPN1 (0.45) ERN1GAAMAOAMAOBMAPT
SCHEMBL6422110 0.73 MAOB (0.46) MAOBMAPTMAPK1TDP1BACE1
SCHEMBL6422106 0.73 MAOB (0.46) MAOBMAPTMAPK1TDP1BACE1
SCHEMBL25877625 0.72 L3MBTL1 (0.50) ERN1MAOAMAOBMAPTMAPK1
SCHEMBL1638769 0.72 PTGER1 (0.46) ERN1PDCD1CD274GSTP1MAOA
SCHEMBL1406410 0.71 MAOB (0.44) ERN1GSTP1GAAMGAMSI
SCHEMBL16018687 0.71 MAPT (0.51) ERN1GAAMAOAMAOBMAPT
SCHEMBL25817126 0.71 PTPN1 (0.45) ERN1GAAMAOAMAOBMAPT

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
CN-1659132-A Novel ligands as RAR receptor inhibitors, process for their preparation and their use in human medicine and cosmetics GALDERMA RES & DEV (FR) 2005-08-24 CN disclosed
EP-1513793-A1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS Galderma Research & Development, S.N.C. (FR) 2005-03-16 EP disclosed
WO-2003101928-A1 NOVEL LIGANDS THAT ARE INHIBITORS OF THE RAR RECEPTORS, PROCESS FOR PREPARING THEM AND USE THEREOF IN HUMAN MEDICINE AND IN COSMETICS GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2003-12-11 WO disclosed