SCHEMBL6747889

SCHEMBL6747889

CCCCCC1CCC(/C=C/c2ccc3cc(OCc4ccccc4)ccc3c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.44
LCK P06239 1/20 0.44
PLA2G2D Q9UNK4 1/20 0.39
CYP2D6 P10635 1/20 0.38
HRH1 P35367 1/20 0.38
HRH3 Q9Y5N1 1/20 0.38
CCNB2 O95067 1/20 0.37
CDK1 P06493 1/20 0.37
CDK4 P11802 1/20 0.37
CCNB1 P14635 1/20 0.37
CCND1 P24385 1/20 0.37
CCNB3 Q8WWL7 1/20 0.37
APP P05067 1/20 0.37
MAPT P10636 1/20 0.37
NPC1 O15118 2/20 0.37
RAB9A P51151 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL6747890 1.00 ALOX5 (0.44) ALOX5LCKPLA2G2DCYP2D6HRH1
SCHEMBL6747893 1.00 ALOX5 (0.44) ALOX5LCKPLA2G2DCYP2D6HRH1
SCHEMBL28007659 0.91 LCK (0.44) LCKMAPTNPC1RAB9AKDM4E
SCHEMBL28007660 0.91 LCK (0.44) LCKMAPTNPC1RAB9AKDM4E
SCHEMBL9255048 0.88 LCK (0.42) LCKMAPTNPC1RAB9AKDM4E
SCHEMBL9180238 0.78 MAOA (0.43)
SCHEMBL9180243 0.78 MAOA (0.43)
SCHEMBL7672453 0.76 MAOA (0.37) MAPTALDH1A1
SCHEMBL7672459 0.76 MAOA (0.37) MAPTALDH1A1
SCHEMBL13679800 0.73 BCHE (0.36) CYP2D6CYP3A4BCHE

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-6703082-B1 VARIOUS NAPHTHALENE-CONTAINING LIQUID CRYSTALS DISPLAYTECH, INC. 2004-03-09 US disclosed