SCHEMBL5867141

SCHEMBL5867141

CCCCCCCCCCCCCCCCOc1ccc(OC(=O)C([O])=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.61
TSHR P16473 1/20 0.61
PLA2G4B P0C869 2/20 0.59
NR5A1 Q13285 1/20 0.59
NPC1 O15118 2/20 0.58
LMNA P02545 2/20 0.58
NFKB1 P19838 1/20 0.58
NFKB2 Q00653 1/20 0.58
RELA Q04206 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
RARB P10826 3/20 0.56
CYP1A2 P05177 1/20 0.56
CYP3A4 P08684 1/20 0.56
CYP2D6 P10635 1/20 0.56
CYP2C9 P11712 1/20 0.56
CYP2C19 P33261 1/20 0.56
FAAH O00519 6/20 0.56
PLA2G4A P47712 1/20 0.54

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
SCHEMBL5867144 0.87 TP53 (0.66) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL55063 0.86 TP53 (0.65) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL9670514 0.86 TP53 (0.65) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL8518384 0.85 TP53 (0.59) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL77123 0.85 TP53 (0.59) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL9671377 0.84 TP53 (0.62) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL27821661 0.84 TSHR (0.58) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL21847975 0.84 TSHR (0.58) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL9670519 0.83 TP53 (0.70) TP53TSHRPLA2G4BNR5A1NPC1
SCHEMBL8081520 0.83 TP53 (0.65) TP53TSHRPLA2G4BNR5A1NPC1

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
US-7056652-B2 Silver salt photothermographic dry imaging material KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2006-06-06 US disclosed
US-20050112514-A1 Silver salt photothermographic dry imaging material KONICA MINOLTA MEDICAL & GRAPHIC, INC. 2005-05-26 US disclosed