SCHEMBL8730860

SCHEMBL8730860

C=C(CCCCC(=C)c1ccc(C)cc1)c1ccc(C)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.46
ALDH1A1 P00352 5/20 0.42
LMNA P02545 2/20 0.42
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
KMT2A Q03164 3/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
GSK3B P49841 1/20 0.40
ACHE P22303 1/20 0.38
PKM P14618 2/20 0.38
HTT P42858 2/20 0.38
ATM Q13315 2/20 0.38
NPSR1 Q6W5P4 2/20 0.38
MEN1 O00255 2/20 0.38
HPGD P15428 1/20 0.38
NLRP1 Q9C000 1/20 0.38
GAA P10253 1/20 0.38
NTSR1 P30989 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 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
SCHEMBL19042193 0.92 L3MBTL1 (0.46) TDP1ALDH1A1LMNACES2CES1
SCHEMBL2010661 0.90 L3MBTL1 (0.49) TDP1ALDH1A1LMNACES2CES1
SCHEMBL7193415 0.89 ALDH1A1 (0.44) TDP1ALDH1A1LMNACES2CES1
SCHEMBL28972199 0.89 KMT2A (0.38) TDP1ALDH1A1LMNACES2CES1
SCHEMBL809922 0.87 KMT2A (0.37) TDP1ALDH1A1LMNACES2CES1
SCHEMBL809696 0.87 KMT2A (0.37) TDP1ALDH1A1LMNACES2CES1
SCHEMBL19043353 0.87 TDP1 (0.38) TDP1ALDH1A1LMNACES2CES1
SCHEMBL7197697 0.84 ALDH1A1 (0.41) TDP1ALDH1A1LMNACES2CES1
SCHEMBL23192702 0.82 KMT2A (0.39) TDP1ALDH1A1LMNACES2CES1
SCHEMBL22335232 0.82 CYP1A2 (0.41) ALDH1A1LMNACES2CES1KMT2A

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
JP-4041513-A None JP disclosed
EP-0678526-B1 Ethylene polymers having both ends modified and processes for the production thereof TONEN CORP (JP) 1998-04-01 EP disclosed
EP-0227124-B2 Olefinic benzocyclobutene polymers and processes for the preparation thereof SHELL INT RESEARCH (NL) 1996-01-31 EP disclosed
EP-0678526-A2 Ethylene polymers having both ends modified and processes for the production thereof Tonen Corporation (JP) 1995-10-25 EP disclosed
EP-0532804-B1 An ethylene polymer and a process for its production TONEN CORP (JP) 1995-06-28 EP disclosed
US-5367033-A Hydroxy or carboxy endcapped polyethylene reacted with diol or diacid TONEN CORPORATION (JP) 1994-11-22 US disclosed
US-5334678-A Using a coordination catalyst containing a vanadium chelate compound and a dialkylaluminum halide TONEN CORPORATION (JP) 1994-08-02 US disclosed
EP-0532804-A1 An ethylene polymer and a process for its production Tonen Corporation (JP) 1993-03-24 EP disclosed
EP-0530408-A1 Olefin polymers having both ends modified and processes for the production thereof Tonen Corporation (JP) 1993-03-10 EP disclosed
JP-H0441513-A ETHYLENE POLYMER HAVING MODIFIED TERMINALS AND ITS PRODUCTION TONEN CORP 1992-02-12 JP disclosed
US-4722974-A POLYMERIZED WITH UNSATURATED AROMATIC HYDROCARBON AND CONJUGATED DIENES; CROSSLINKABLE; SOLVENT RESISTANT SHELL OIL COMPANY (US) 1988-02-02 US disclosed
US-4687815-A Hydrogenated block copolymers SHELL OIL COMPANY (US) 1987-08-18 US disclosed
EP-0227124-A2 Olefinic benzocyclobutene polymers and processes for the preparation thereof SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 1987-07-01 EP disclosed