SCHEMBL6934825

SCHEMBL6934825

CC(C)=CCCC(C)CCc1ccccc1NN

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.40
TSHR P16473 1/20 0.40
NFE2L2 Q16236 1/20 0.36
TDP1 Q9NUW8 2/20 0.35
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
SRC P12931 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
MSR1 P21757 1/20 0.33
SLC6A2 P23975 1/20 0.33
SLC6A4 P31645 1/20 0.33
SLC6A3 Q01959 1/20 0.33
GGPS1 O95749 1/20 0.32
FDPS P14324 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
SCHEMBL6941308 0.87 ALOX15 (0.41) ALOX15ALDH1A1KDM4ETSHRNFE2L2
SCHEMBL6937909 0.77 ALDH1A1 (0.39) ALDH1A1TDP1GAAMAPTL3MBTL1
SCHEMBL4940586 0.77 ALOX15 (0.52) ALOX15ALDH1A1KDM4ETSHRNFE2L2
SCHEMBL14450995 0.76 TAAR1 (0.45) ALOX15ALDH1A1KDM4ETSHR
SCHEMBL6942396 0.76 TYR (0.42) ALDH1A1TDP1GAAMAPTL3MBTL1
SCHEMBL6937591 0.75 SLC6A2 (0.42) ALDH1A1TDP1GAAMAPTL3MBTL1
SCHEMBL5604502 0.75 FOLH1 (0.46) ALOX15ALDH1A1KDM4ETSHRNFE2L2
SCHEMBL585340 0.75 FOLH1 (0.46) ALOX15ALDH1A1KDM4ETSHRNFE2L2
SCHEMBL5604934 0.75 FOLH1 (0.46) ALOX15ALDH1A1KDM4ETSHRNFE2L2
SCHEMBL9956686 0.75 ALOX15 (0.43) ALOX15ALDH1A1KDM4ETSHRNFE2L2

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-1272456-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS Abbott Laboratories (US) 2003-01-08 EP disclosed
WO-2001079157-A1 HYDRAZIDE AND ALKOXYAMIDE ANGIOGENESIS INHIBITORS ABBOTT LABORATORIES (US) 2001-10-25 WO disclosed