SCHEMBL4019968

SCHEMBL4019968

CCCCCCCCCCCCC(Oc1ccc(O)c(CCCC)c1)C([NH])=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
TSHR P16473 2/20 0.41
ALDH2 P05091 2/20 0.39
CNR2 P34972 4/20 0.39
CTRC Q99895 1/20 0.39
PPARA Q07869 2/20 0.38
ALOX5 P09917 2/20 0.38
PTGES O14684 1/20 0.38
PPARG P37231 1/20 0.38
CYP3A4 P08684 3/20 0.38
HTR1A P08908 3/20 0.38
CYP2C8 P10632 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2A6 P11509 2/20 0.38
CYP2C9 P11712 2/20 0.38
CYP2B6 P20813 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2E1 P05181 1/20 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
SCHEMBL158901 0.88 GABRA1 (0.40) ALDH2CTRCPPARAALOX5PTGES
SCHEMBL4016573 0.88 MTNR1A (0.41) MTNR1AMTNR1BTSHRALDH2CNR2
SCHEMBL75503 0.81 ATM (0.57) ALDH2CTRCMAPT
SCHEMBL10377004 0.79 CTRC (0.44) ALDH2CTRCPPARAALOX5PPARG
SCHEMBL4016570 0.79 ALOX5 (0.43) TSHRALDH2CNR2ALOX5CYP3A4
SCHEMBL9820143 0.78 PPARA (0.56) CTRCPPARAALOX5PTGESPPARG
SCHEMBL7784485 0.77 CTRC (0.52) TSHRCNR2CTRCPPARAALOX5
SCHEMBL10378987 0.76 TP53 (0.56) TSHRCTRCTP53KMT2A
SCHEMBL5270700 0.76 ALOX5 (0.55) TSHRALDH2CNR2CTRCPPARA
SCHEMBL8617946 0.74 CTRC (0.61) ALDH2CTRCPPARALTA4HKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2013314-A1 ELECTROLUMINESCENT DEVICE INCLUDING AN ANTHRACENE DERIVATIVE EASTMAN KODAK COMPANY (US) 2009-01-14 EP disclosed
EP-1897416-A1 ELECTROLUMINESCENT DEVICES WITH NITROGEN BIDENTATE LIGANDS EASTMAN KODAK COMPANY (US) 2008-03-12 EP disclosed
EP-1856228-A1 ELECTROLUMINESCENT DEVICES WITH MIXED ELECTRON TRANSPORT MATERIALS EASTMAN KODAK COMPANY (US) 2007-11-21 EP disclosed
WO-2007130263-A1 ELECTROLUMINESCENT DEVICE INCLUDING AN ANTHRACENE DERIVATIVE EASTMAN KODAK COMPANY (US) 2007-11-15 WO disclosed
WO-2007127069-A1 ELECTROLUMINESCENT DEVICE INCLUDING AN ANTHRACENE DERIVATIVE EASTMAN KODAK COMPANY (US) 2007-11-08 WO disclosed
WO-2007005252-A1 ELECTROLUMINESCENT DEVICES WITH NITROGEN BIDENTATE LIGANDS EASTMAN KODAK COMPANY (US) 2007-01-11 WO disclosed
WO-2006098885-A1 ELECTROLUMINESCENT DEVICES WITH MIXED ELECTRON TRANSPORT MATERIALS EASTMAN KODAK COMPANY (US) 2006-09-21 WO disclosed