SCHEMBL14635883

SCHEMBL14635883

CCC(CCC(C)C)Sc1ccc(C)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 5/20 0.41
ALDH1A1 P00352 5/20 0.35
LMNA P02545 3/20 0.35
MAPT P10636 3/20 0.35
KMT2A Q03164 3/20 0.35
USP2 O75604 1/20 0.35
PTGES O14684 1/20 0.35
ALOX5 P09917 1/20 0.35
PPARG P37231 1/20 0.35
PPARA Q07869 1/20 0.35
POLB P06746 2/20 0.33
GAA P10253 1/20 0.33
DNMT1 P26358 1/20 0.32
MEN1 O00255 2/20 0.32
MAPK1 P28482 2/20 0.32
ATM Q13315 2/20 0.32
HSP90AA1 P07900 1/20 0.32
AGTR1 P30556 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL11448460 0.85 PTGES (0.39) HPGDALDH1A1LMNAMAPTKMT2A
SCHEMBL28437615 0.80 HPGD (0.44) HPGDALDH1A1MAPTUSP2PTGES
SCHEMBL415481 0.76 KMT2A (0.44) HPGDALDH1A1LMNAMAPTKMT2A
SCHEMBL1453567 0.76 ALDH1A1 (0.35) HPGDALDH1A1LMNAMAPTKMT2A
SCHEMBL28429787 0.76 HPGD (0.40) HPGDALDH1A1LMNAMAPTKMT2A
SCHEMBL20727184 0.73 TYR (0.39) LMNAMAPTTDP1HTTCYP1A2
SCHEMBL11758121 0.72 HPGD (0.42) HPGDALDH1A1LMNAMAPTKMT2A
SCHEMBL27944941 0.71 MAPT (0.41) HPGDALDH1A1LMNAMAPTKMT2A
SCHEMBL12856933 0.70 PPARG (0.47) HPGDALDH1A1LMNAMAPTKMT2A
SCHEMBL28435667 0.69 PTGES (0.37) HPGDALDH1A1LMNAMAPTKMT2A

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
EP-1748306-A1 AUTHENTICITY JUDGING MEDIUM, BASE MATERIAL CAPABLE OF JUDGING AUTHENTICITY, AUTHENTICITY JUDGING MEDIUM LABEL, AUTHENTICITY JUDGING MEDIUM TRANSFER SHEET, SHEET CAPABLE OF JUDGING AUTHENTICITY, AND INFORMATION RECORDING ELEMENT CAPABLE OF JUDGING AUTHENTICITY Dainippon Printing Co., Ltd. (JP) 2007-01-31 EP disclosed