SCHEMBL7743672

SCHEMBL7743672

C=C(CCCCC)CC(C)CCCCCC

nearest known ligand 0.44

Predicted protein targets (top 13)

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
GPR84 Q9NQS5 4/20 0.37
MEN1 O00255 1/20 0.37
FAAH O00519 1/20 0.37
MAPK1 P28482 1/20 0.37
KMT2A Q03164 1/20 0.37
CES2 O00748 2/20 0.37
CES1 P23141 2/20 0.37
OPRM1 P35372 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
SCHEMBL7743761 1.00 ACE2 (0.44) ACE2FFAR4FFAR1SPHK1LMNA
SCHEMBL7744228 0.96 ACE2 (0.40) ACE2FFAR4FFAR1LMNAGPR84
SCHEMBL7743773 0.92 TSHR (0.38) ACE2FFAR4FFAR1LMNAGPR84
SCHEMBL26977437 0.89 LMNA (0.38) ACE2FFAR4FFAR1LMNAMEN1
SCHEMBL7744146 0.89 LMNA (0.41) ACE2SPHK1LMNAGPR84MEN1
SCHEMBL26977248 0.86 SMN1; SMN2 (0.36) ACE2FFAR4LMNAMEN1FAAH
SCHEMBL27405508 0.86 ALDH1A1 (0.38) ACE2FFAR4FFAR1SPHK1LMNA
SCHEMBL23923682 0.86 ACE2 (0.50) ACE2FFAR4FFAR1SPHK1LMNA
SCHEMBL7744145 0.86 LMNA (0.38) LMNAGPR84MEN1FAAHMAPK1
SCHEMBL23567507 0.85 SPHK1 (0.37) SPHK1MEN1KMT2AOPRM1

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