SCHEMBL7746082

SCHEMBL7746082

C=C(CCCCCC)CCCCC(C)CC

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.44
FFAR4 Q5NUL3 1/20 0.40
FFAR1 O14842 1/20 0.40
SPHK1 Q9NYA1 1/20 0.39
LMNA P02545 3/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
MEN1 O00255 1/20 0.37
FAAH O00519 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL7743439 1.00 ACE2 (0.44) ACE2FFAR4FFAR1SPHK1LMNA
SCHEMBL7743511 0.96 ACE2 (0.40) ACE2LMNAALDH1A1TSHRMEN1
SCHEMBL7746021 0.92 ALDH1A1 (0.39) LMNAALDH1A1TSHRMEN1FAAH
SCHEMBL26022372 0.92 ALDH1A1 (0.39) LMNAALDH1A1TSHRMEN1FAAH
SCHEMBL24681420 0.92 ALDH1A1 (0.39) LMNAALDH1A1TSHRMEN1FAAH
SCHEMBL23923682 0.90 ACE2 (0.50) ACE2FFAR4FFAR1SPHK1LMNA
SCHEMBL7746036 0.88 LMNA (0.32) ACE2LMNA
SCHEMBL27795701 0.86 ACE2 (0.43) ACE2FFAR4FFAR1SPHK1LMNA
SCHEMBL7744198 0.86 ACE2 (0.46) ACE2FFAR4FFAR1SPHK1LMNA
SCHEMBL7738197 0.86 ACE2 (0.46) ACE2FFAR4FFAR1SPHK1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001002512-A1 USE OF DIMERIZED FISCHER-TROPSCH PROCESS PRODUCTS AND VINYLIDENE DERIVATIVES THEREOF SASOL TECHNOLOGY (PTY) LTD. (ZA) 2001-01-11 WO disclosed