SCHEMBL6948839

SCHEMBL6948839

COCCCCOc1c(C)cccc1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.55
KDM4E B2RXH2 4/20 0.55
HPGD P15428 3/20 0.55
HSD17B10 Q99714 2/20 0.55
HTT P42858 1/20 0.44
POLB P06746 1/20 0.43
MYC P01106 1/20 0.42
MAPT P10636 1/20 0.42
PTPN1 P18031 1/20 0.42
MAPK1 P28482 1/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL2216094 0.92 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL27676707 0.86 PTPN11 (0.56) ALDH1A1KDM4EHPGDHSD17B10MAPT
SCHEMBL6948220 0.86 LMNA (0.46) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL382128 0.86 KDM4E (0.57) ALDH1A1KDM4EHPGDHSD17B10
SCHEMBL28602270 0.86 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL7695345 0.84 KDM4E (0.55) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL13951454 0.84 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDHSD17B10POLB
SCHEMBL29263206 0.84 PTPN1 (0.59) ALDH1A1KDM4EHPGDHSD17B10HTT
SCHEMBL383490 0.84 ALDH1A1 (0.58) ALDH1A1KDM4EHPGDHSD17B10MYC
SCHEMBL29057024 0.83 ALDH1A1 (0.57) ALDH1A1KDM4EHPGDHSD17B10MYC

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
WO-2003103652-A1 METHODS OF TREATING ALZHEIMER’S DISEASE USING AROMATICALLY SUBSTITUTED ω-AMINO-ALKANOIC ACID AMIDES AND ALKANOIC ACID DIAMIDES ELAN PHARMACEUTICALS, INC. (US) 2003-12-18 WO disclosed