SCHEMBL6903530

SCHEMBL6903530

CCCCCCCCCCCCCCCCC=Cc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TNNC1 P63316 1/20 0.50
EGFR P00533 1/20 0.49
SOAT2 O75908 1/20 0.47
SOAT1 P35610 1/20 0.47
SIGMAR1 Q99720 2/20 0.47
FAAH O00519 2/20 0.45
EPHX2 P34913 2/20 0.45
CYSLTR2 Q9NS75 2/20 0.45
CYSLTR1 Q9Y271 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
HTR2A P28223 3/20 0.44
TP53 P04637 1/20 0.43
MAPT P10636 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CNR1 P21554 1/20 0.43
CNR2 P34972 1/20 0.43

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
SCHEMBL29828 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL10625168 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL9172117 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL455310 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL6905623 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL2168403 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL363637 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL7796983 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL465270 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1
SCHEMBL2555594 1.00 TNNC1 (0.50) TNNC1EGFRSOAT2SOAT1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4068676-A RELEASE AGENTS HALLIBURTON COMPANY (US) 1978-01-17 US claimed
US-6730747-B1 FORMED FROM ACYCLIC CARBONYL COMPOUNDS AND UNSATURATED HYDROCARBONS INFINEUM USA L.P. 2004-05-04 US disclosed
US-6462140-B2 CONTACTING AN OLEFIN POLYMER CONTAINING AN ALLYLIC HYDROGEN AND HAVING A MOLECULAR WEIGHT BETWEEN 500 AND 10,000,000 WITH AN ACYCLIC CARBONYL EXXON RESEARCH & ENGINEERING CO. 2002-10-08 US disclosed
US-20010007893-A1 Carbonyl containing compounds EXXON RESEARCH & ENGINEERING CO. 2001-07-12 US disclosed
US-6077915-A Carbonyl containing compounds EXXON RESEARCH & ENGINEERING (US) 2000-06-20 US disclosed
EP-0738253-A4 CARBONYL CONTAINING COMPOUNDS EXXON RESEARCH ENGINEERING CO (US) 1997-03-12 EP disclosed
EP-0738253-A1 CARBONYL CONTAINING COMPOUNDS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1996-10-23 EP disclosed
US-RE35004-E Cyclic carbonyl containing polymers EXXON RESEARCH & ENGINEERING CO. (US) 1995-07-25 US disclosed
WO-1995015303-A1 CARBONYL CONTAINING COMPOUNDS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1995-06-08 WO disclosed
US-5057564-A Ene addition of a cyclic carbonyl to an unsaturated compound or an addition polymer; chemical intermediates for thickeners EXXON RESEARCH AND ENGINEERING COMPANY (US) 1991-10-15 US disclosed
US-4068676-A RELEASE AGENTS HALLIBURTON COMPANY (US) 1978-01-17 US disclosed