SCHEMBL9133997

SCHEMBL9133997

CCCCCCCC(C)C(C)=C(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.50
ACE2 Q9BYF1 1/20 0.45
FDPS P14324 4/20 0.45
SPHK1 Q9NYA1 1/20 0.45
LMNA P02545 1/20 0.44
OPRM1 P35372 1/20 0.42
FFAR1 O14842 2/20 0.41
FFAR4 Q5NUL3 1/20 0.41
GPR84 Q9NQS5 3/20 0.40
MAPT P10636 1/20 0.39
TP53 P04637 1/20 0.39

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
SCHEMBL23754595 1.00 CA1 (0.50) CA1ACE2FDPSSPHK1LMNA
SCHEMBL6031748 1.00 CA1 (0.50) CA1ACE2FDPSSPHK1LMNA
SCHEMBL9131876 1.00 CA1 (0.50) CA1ACE2FDPSSPHK1LMNA
SCHEMBL4409947 1.00 CA1 (0.50) CA1ACE2FDPSSPHK1LMNA
Bromide SCHEMBL27525258 0.98 CA1 (0.48) CA1ACE2FDPSSPHK1LMNA
SCHEMBL8656544 0.98 CA1 (0.52) CA1ACE2FDPSSPHK1LMNA
SCHEMBL31560157 0.90 CA1 (0.43) CA1ACE2FDPSSPHK1OPRM1
SCHEMBL28689888 0.84 ACE2 (0.48) CA1ACE2FDPSSPHK1LMNA
SCHEMBL332376 0.82 CA1 (0.47) CA1ACE2FDPSSPHK1LMNA
SCHEMBL23442701 0.82 CA1 (0.47) CA1ACE2FDPSSPHK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5466838-A Catalytic reaction of olefin with oxygen in the presence of aldehyde SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1995-11-14 US disclosed
EP-0540009-B1 Process for producing epoxides SUMITOMO CHEMICAL CO (JP) 1995-08-30 EP disclosed
US-5367087-A Process for producing epoxide SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1994-11-22 US disclosed
EP-0540009-A1 Process for producing epoxides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-05-05 EP disclosed