SCHEMBL9750829

SCHEMBL9750829

CCCCC(OC(CCCC)C(C)(C)CC)C(C)(C)CC

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.33
DNM1 Q05193 2/20 0.33
CA1 P00915 2/20 0.33
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 2/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL9750786 0.93 OPRM1 (0.36) CA2DNM1
SCHEMBL30549091 0.91 LMNA (0.37) CA2DNM1ALDH1A1
SCHEMBL9750933 0.91 LMNA (0.37) CA2DNM1ALDH1A1
SCHEMBL4392359 0.85
SCHEMBL4451765 0.80 DNM1 (0.36) CA2DNM1CA1MAPK1ALDH1A1
SCHEMBL29083538 0.80 FDPS (0.35) CA2
SCHEMBL27805623 0.77 OPRM1 (0.34) CA2DNM1
SCHEMBL7519191 0.74 TSHR (0.32) ALDH1A1TDP1
SCHEMBL4556906 0.73 OPRM1 (0.39) CA2DNM1
SCHEMBL4647251 0.73 DNM1 (0.35) CA2DNM1CA1ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0284005-B1 METHOD OF PRODUCTION OF POLYOLEFINS IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1991-12-18 EP disclosed
US-4981930-A POLYMERIZATION CATALYSTS IDEMITSU PETROCHEMICAL COMPANY LIMITED (JP) 1991-01-01 US disclosed
EP-0284005-A2 Method of production of polyolefins IDEMITSU PETROCHEMICAL CO. LTD. (JP) 1988-09-28 EP disclosed