SCHEMBL9189537

SCHEMBL9189537

CCCCCCCC[C@H]1CC[C@H](CCCOc2ccc(OCCCCC)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR5A1 Q13285 1/20 0.56
LTA4H P09960 3/20 0.51
TP53 P04637 3/20 0.50
TSHR P16473 1/20 0.50
PLA2G4B P0C869 1/20 0.49
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
LMNA P02545 2/20 0.47
HPGD P15428 1/20 0.47
RARB P10826 3/20 0.46
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
S1PR5 Q9H228 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
SCHEMBL9345069 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9346400 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9346216 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9346421 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9349227 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9349571 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9344254 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9349180 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9349093 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B
SCHEMBL9345081 1.00 NR5A1 (0.56) NR5A1LTA4HTP53TSHRPLA2G4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0423520-B1 Liquid crystalline composition for the use in a twisted nematic cell MERCK PATENT GMBH (DE) 1995-08-02 EP disclosed
EP-0423520-A2 Liquid crystalline composition for the use in a twisted nematic cell MERCK PATENT GmbH (DE) 1991-04-24 EP disclosed