SCHEMBL9016966

SCHEMBL9016966

C(=C/CN(c1ccccc1)c1ccccc1)\CN(Cc1ccccc1)Cc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TK1 P04183 1/20 0.43
CNR2 P34972 1/20 0.42
TSHR P16473 2/20 0.41
ALDH1A1 P00352 2/20 0.39
NR3C2 P08235 1/20 0.38
KCNH2 Q12809 3/20 0.37
MAOB P27338 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
AOC3 Q16853 1/20 0.36
KCNA3 P22001 1/20 0.36
CYP2C19 P33261 1/20 0.36
NPC1 O15118 1/20 0.36
GLA P06280 1/20 0.36
HTT P42858 1/20 0.36
RAB9A P51151 1/20 0.36
PAX8 Q06710 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL9016968 1.00 TK1 (0.43) TK1CNR2TSHRALDH1A1NR3C2
SCHEMBL9016986 0.88 TK1 (0.49) TK1CNR2TSHRALDH1A1KCNH2
SCHEMBL8421536 0.88 TK1 (0.49) TK1CNR2TSHRALDH1A1KCNH2
SCHEMBL39114 0.83 KCNH2 (0.38) TSHRALDH1A1KCNH2MAOBCYP2C19
SCHEMBL9016977 0.83 KCNH2 (0.38) TSHRALDH1A1KCNH2MAOBCYP2C19
SCHEMBL5073289 0.76 TSHR (0.46) TK1CNR2TSHRALDH1A1KCNH2
SCHEMBL5073288 0.76 TSHR (0.46) TK1CNR2TSHRALDH1A1KCNH2
SCHEMBL516674 0.75 BCHE (0.49) CNR2TSHRALDH1A1AOC3HTT
SCHEMBL1931710 0.74 MEN1 (0.54) TSHRKCNH2CYP2C19HTT
SCHEMBL1931712 0.74 MEN1 (0.54) TSHRKCNH2CYP2C19HTT

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-0514333-A2 Substituted 1,4-diamino-2-butene stabilizers and stabilized compositions CIBA-GEIGY AG (CH) 1992-11-19 EP claimed
US-5492954-A STABILIZE LUBRICANTS AND SYNTHETIC POLYMERS AGAINST THE DELETERIOUS EFFECTS OF OXYGEN AND HEAT CIBA-GEIGY CORPORATION (US) 1996-02-20 US disclosed
US-5391808-A Lubricant and synthetic polymer additives for heat and oxidation resistance CIBA-GEIGY CORPORATION (US) 1995-02-21 US disclosed
EP-0585202-A1 N,N'-alkenylene amine/mercaptotolyl-imidazole blends as high temperature antioxidants for elastomers CIBA-GEIGY AG (CH) 1994-03-02 EP disclosed
US-5283367-A Antioxidants for lubricants and polymers CIBA-GEIGY CORPORATION (US) 1994-02-01 US disclosed
US-5240976-A For automobile, wire and cable uses CIBA-GEIGY CORPORATION (US) 1993-08-31 US disclosed
EP-0514333-A2 Substituted 1,4-diamino-2-butene stabilizers and stabilized compositions CIBA-GEIGY AG (CH) 1992-11-19 EP disclosed