SCHEMBL3974381

SCHEMBL3974381

C=CC(=C)C.C=Cc1ccccc1C=C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
TSHR P16473 2/20 0.50
TP53 P04637 2/20 0.50
CYP3A4 P08684 3/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
AKT1 P31749 1/20 0.34
GSR P00390 1/20 0.34
LMNA P02545 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
HDAC8 Q9BY41 1/20 0.32
THRB P10828 1/20 0.32
BLM P54132 1/20 0.32
ESR2 Q92731 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32

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
SCHEMBL1628414 0.98 ALDH1A1 (0.48) ALDH1A1TSHRTP53CYP3A4MEN1
Butadiene SCHEMBL28196532 0.95 ALDH1A1 (0.46) ALDH1A1TSHRTP53CYP3A4MEN1
SCHEMBL3146710 0.90 ALDH1A1 (0.50) ALDH1A1TSHRTP53CYP3A4MEN1
Styrene SCHEMBL26122589 0.89 ALDH1A1 (0.56) ALDH1A1TSHRTP53CYP3A4MEN1
SCHEMBL27634483 0.87 ALDH1A1 (0.45) ALDH1A1TSHRTP53CYP3A4MEN1
SCHEMBL27874456 0.87 ALDH1A1 (0.45) ALDH1A1TSHRTP53CYP3A4MEN1
Methyl Alcohol SCHEMBL28639807 0.84 ALDH1A1 (0.55) ALDH1A1TSHRTP53CYP3A4MEN1
Acetone SCHEMBL11802482 0.82 ALDH1A1 (0.48) ALDH1A1TSHRCYP3A4MEN1KMT2A
SCHEMBL28661070 0.81 ALDH1A1 (0.52) ALDH1A1TSHRCYP3A4MEN1KMT2A
SCHEMBL9246872 0.81 ALDH1A1 (0.43) ALDH1A1TSHRCYP3A4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389451-B2 Lubricant air release rates EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2013-03-05 US claimed
EP-2049632-A2 IMPROVING LUBRICANT AIR RELEASE RATES ExxonMobil Research and Engineering Company (US) 2009-04-22 EP claimed
WO-2008013752-A2 IMPROVING LUBRICANT AIR RELEASE RATES EXXONMOBIL RESEARCH AND ENGINEERING COMPANY (US) 2008-01-31 WO claimed
US-20080026969-A1 Lubricant air release rates EXXONMOBIL RESEARCH AND ENGINEERING COMPANY 2008-01-31 US claimed
CN-110330759-A A kind of compositions of thermosetting resin and its application 南亚新材料科技股份有限公司 2019-10-15 CN disclosed
CN-110317445-A A kind of high frequency resin composition and its application 南亚新材料科技股份有限公司 2019-10-11 CN disclosed
US-20150344813-A1 LUBRICATING OIL COMPOSITIONS INFINEUM INTERNATIONAL LIMITED (GB) 2015-12-03 US disclosed
CN-1309674-A Polymerization of Conjugated Dienes Using Rare Earth Catalysts in the Presence of Vinyl Aromatic Solvents BAYER AG (DE) 2001-08-22 CN disclosed
EP-0874885-B1 CRANKCASE LUBRICATING COMPOSITIONS INFINEUM USA LP (US) 1999-10-20 EP disclosed
WO-1998021297-A1 LUBRICATING OIL FORMULATIONS WITH IMPROVED LOW TEMPERATURE PERFORMANCE EXXON CHEMICAL PATENTS INC. (US) 1998-05-22 WO disclosed