SCHEMBL10799489

SCHEMBL10799489

CCCCCCCCCCC(COC(C)=O)(COC(C)=O)COC(C)=O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
FAAH O00519 1/20 0.44
CES2 O00748 2/20 0.41
TSHR P16473 2/20 0.40
NAAA Q02083 1/20 0.39
DGKA P23743 1/20 0.39
GGPS1 O95749 1/20 0.39
LMNA P02545 1/20 0.39
HSD17B10 Q99714 1/20 0.39
SMPD1 P17405 1/20 0.39
FDPS P14324 2/20 0.38

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
SCHEMBL10794543 1.00 ALDH1A1 (0.48) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL9001056 1.00 ALDH1A1 (0.48) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL9001061 1.00 ALDH1A1 (0.48) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL10795327 0.98 ALDH1A1 (0.50) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL9001058 0.92 ALDH1A1 (0.52) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL11184769 0.91 ALDH1A1 (0.44) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL15542948 0.84 ALDH1A1 (0.48) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL30010780 0.84 ALDH1A1 (0.48) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL9261901 0.83 ALDH1A1 (0.46) ALDH1A1MEN1MAPTKMT2AATM
SCHEMBL6202131 0.82 ALDH1A1 (0.47) ALDH1A1MEN1MAPTKMT2AATM

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
US-4655947-A FOR HOT AND COLD ROLLING ALUMINUM AND ALLOYS THEREOF ALUMINUM COMPANY OF AMERICA (US) 1987-04-07 US disclosed