SCHEMBL5603288

SCHEMBL5603288

CCCCC1(CCCC)CCCC2=C1[N]c1ccccc12

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CETP P11597 4/20 0.32
ALOX12 P18054 1/20 0.32
OPRM1 P35372 1/20 0.31
OPRL1 P41146 1/20 0.31
EBP Q15125 1/20 0.30
SIGMAR1 Q99720 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
SCHEMBL5603997 0.96 CETP (0.32) CETPSIGMAR1
SCHEMBL5603380 0.95 CETP (0.33) CETPOPRM1OPRL1SIGMAR1
SCHEMBL5600959 0.92
SCHEMBL5601387 0.86
SCHEMBL5603449 0.75 IDO1 (0.30)
SCHEMBL5603980 0.69
SCHEMBL5600498 0.69 HSD11B1 (0.32) OPRM1OPRL1
SCHEMBL5602361 0.68 OPRM1 (0.33) CETPOPRM1OPRL1SIGMAR1
SCHEMBL3296187 0.66 SIGMAR1 (0.54) EBPSIGMAR1
SCHEMBL5601956 0.66 IDO1 (0.33)

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
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US claimed
US-7276567-B2 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENTS INC. (US) 2007-10-02 US disclosed
US-20050261449-A1 Heterocyclic substituted metallocene compounds for olefin polymerization EXXONMOBIL CHEMICAL PATENT INC. 2005-11-24 US disclosed