SCHEMBL27618641

SCHEMBL27618641

CCCCCCCCCCCCCCCCCCC1CC[CH]CC1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 4/20 0.48
EPHX1 P07099 1/20 0.43
ALDH1A1 P00352 1/20 0.41
HTT P42858 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TP53 P04637 1/20 0.37
LSS P48449 2/20 0.37
PKM P14618 1/20 0.37
SIGMAR1 Q99720 3/20 0.36
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
GNAO1 P09471 1/20 0.36

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
SCHEMBL4923265 1.00 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL4921924 1.00 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL55638 1.00 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL4921810 1.00 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL8744097 1.00 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL1127668 1.00 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL547742 1.00 CYP1A2 (0.48) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL27449477 0.98 CYP1A2 (0.46) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL548259 0.98 CYP1A2 (0.50) CYP1A2EPHX1ALDH1A1HTTMEN1
SCHEMBL455412 0.92 CYP1A2 (0.52) CYP1A2EPHX1ALDH1A1HTTMEN1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101836155-B Liquid crystal aligning agent, method for forming liquid crystal alignment film and liquid crystal display device JSR CORP 2012-01-25 CN disclosed
CN-101836155-A Liquid crystal aligning agent, method for forming liquid crystal alignment film and liquid crystal display device JSR CORP 2010-09-15 CN disclosed
CN-100442570-C Electroluminescent device using metal nano-particles SAMSUNG SDI CO LTD (KR) 2008-12-10 CN disclosed
CN-1612661-A Electroluminescent device using metal nano-particles SAMSUNG SDI CO LTD (KR) 2005-05-04 CN disclosed