SCHEMBL809566

SCHEMBL809566

CCCCCCCCC(C)Nc1ccc(Nc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.58
ALOX15 P16050 4/20 0.58
TSHR P16473 4/20 0.58
HSD17B10 Q99714 4/20 0.58
CYP3A4 P08684 3/20 0.58
ALOX12 P18054 3/20 0.58
MAPK1 P28482 3/20 0.58
HIF1A Q16665 2/20 0.58
TDP1 Q9NUW8 4/20 0.53
L3MBTL1 Q9Y468 3/20 0.53
THRB P10828 2/20 0.53
LMNA P02545 2/20 0.53
RECQL P46063 1/20 0.53
ATM Q13315 1/20 0.53
KMT2A Q03164 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 2/20 0.47
MEN1 O00255 2/20 0.47
KCNH3 Q9ULD8 3/20 0.45
TP53 P04637 1/20 0.44

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
SCHEMBL11353374 1.00 ALDH1A1 (0.58) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL38948 1.00 ALDH1A1 (0.58) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL809646 1.00 ALDH1A1 (0.58) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL1662136 0.98 ALDH1A1 (0.60) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL218597 0.93 ALDH1A1 (0.62) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL18660180 0.93 ALDH1A1 (0.66) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL1454054 0.93 ALDH1A1 (0.47) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL22646172 0.93 ALDH1A1 (0.47) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL18660176 0.93 ALDH1A1 (0.66) ALDH1A1ALOX15TSHRHSD17B10CYP3A4
SCHEMBL11264853 0.93 ALDH1A1 (0.47) ALDH1A1ALOX15TSHRHSD17B10CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8062551-B2 Antiozonant blends CHEMTURA CORPORATION (US) 2011-11-22 US claimed
EP-2013273-B1 ANTIOZONANT BLENDS CHEMTURA CORP (US) 2011-11-16 EP claimed
WO-2011130994-A1 MULTI-USER CHANNEL ESTIMATION METHOD AND DEVICE 中兴通讯股份有限公司 (CN) 2011-10-27 WO claimed
EP-2013273-A1 ANTIOZONANT BLENDS CHEMTURA CORPORATION (US) 2009-01-14 EP claimed
WO-2007130262-A1 ANTIOZONANT BLENDS CHEMTURA CORPORATION (US) 2007-11-15 WO claimed
US-20070260000-A1 Antiozonant blends ADDIVANT USA, LLC 2007-11-08 US claimed
US-8062551-B2 Antiozonant blends CHEMTURA CORPORATION (US) 2011-11-22 US disclosed
EP-2013273-B1 ANTIOZONANT BLENDS CHEMTURA CORP (US) 2011-11-16 EP disclosed
WO-2011130994-A1 MULTI-USER CHANNEL ESTIMATION METHOD AND DEVICE 中兴通讯股份有限公司 (CN) 2011-10-27 WO disclosed
EP-2013273-A1 ANTIOZONANT BLENDS CHEMTURA CORPORATION (US) 2009-01-14 EP disclosed
WO-2007130262-A1 ANTIOZONANT BLENDS CHEMTURA CORPORATION (US) 2007-11-15 WO disclosed
US-20070260000-A1 Antiozonant blends ADDIVANT USA, LLC 2007-11-08 US disclosed
US-4304939-A Preparation of N-phenyl-N-alkylphenylenediamines UOP INC. (US) 1981-12-08 US disclosed