SCHEMBL4865080

SCHEMBL4865080

CCCCCCC(C=Nc1ccc(CCCC)c(CCCC)c1)=Nc1ccc(CCCC)c(CCCC)c1.CCCCc1cccc2c(O)c(O)ccc12.[Pd]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TYR P14679 3/20 0.33
▸ CYP3A4 P08684 3/20 0.32
▸ MAPT P10636 3/20 0.32
▸ ALOX15 P16050 2/20 0.32
▸ MEN1 O00255 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ ALOX5 P09917 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ EP300 Q09472 2/20 0.31
▸ BID P55957 3/20 0.31
▸ MCL1 Q07820 3/20 0.31
▸ BCL2L1 Q07817 2/20 0.31
▸ BAK1 Q16611 2/20 0.31
▸ KAT8 Q9H7Z6 2/20 0.31
▸ SAE1 Q9UBE0 2/20 0.31
▸ IAPP P10997 1/20 0.31
▸ PPARG P37231 1/20 0.31

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
SCHEMBL5919952 0.99 TYR (0.34) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5677386 0.86 CYP3A4 (0.37) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5677377 0.86 CYP3A4 (0.37) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5676854 0.85 CYP3A4 (0.37) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5920945 0.85 CYP3A4 (0.38) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5920942 0.85 CYP3A4 (0.38) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5676849 0.85 CYP3A4 (0.37) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5919855 0.84 CYP3A4 (0.37) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5676646 0.84 CYP3A4 (0.37) TYRCYP3A4MAPTALOX15MEN1
SCHEMBL5921189 0.84 CYP3A4 (0.37) TYRCYP3A4MAPTALOX15MEN1

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-7429548-B2 Soluble late transition metal catalysts for olefin oligomerizations III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2008-09-30 — — US disclosed
US-7067450-B2 Soluble late transition metal catalysts for olefin oligomerizations III EXXONMOBIL CHEMICAL PATENTS INC. (US) 2006-06-27 — — US disclosed
US-20040044150-A1 Soluble late transition metal catalysts for olefin oligomerizations III EXXONMOBIL CHEMICAL PATENTS INC. 2004-03-04 — — US disclosed
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