SCHEMBL7744113

SCHEMBL7744113

C=C(CCCCC)CCCC(C)CCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.42
CES2 O00748 4/20 0.36
CES1 P23141 4/20 0.36
DNM1 Q05193 2/20 0.36
LMNA P02545 2/20 0.35
MEN1 O00255 1/20 0.35
FAAH O00519 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.35
OPRM1 P35372 1/20 0.34
AKR1B1 P15121 1/20 0.34
FFAR4 Q5NUL3 1/20 0.34
FFAR1 O14842 1/20 0.34
PRKD3 O94806 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCH P24723 1/20 0.34
PRKCI P41743 1/20 0.34

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
SCHEMBL23923682 0.94 ACE2 (0.50) ACE2CES2CES1DNM1LMNA
SCHEMBL7738232 0.92 ACE2 (0.44) ACE2CES2CES1LMNAMEN1
SCHEMBL7744131 0.92 ACE2 (0.44) ACE2CES2CES1DNM1LMNA
SCHEMBL23924161 0.92 ACE2 (0.44) ACE2CES2CES1DNM1LMNA
SCHEMBL31521582 0.91 ACE2 (0.42) ACE2CES2CES1LMNAMEN1
SCHEMBL7744198 0.89 ACE2 (0.46) ACE2CES2CES1LMNAMEN1
SCHEMBL23924338 0.89 ACE2 (0.41) ACE2LMNAMEN1FAAHMAPK1
SCHEMBL7738197 0.89 ACE2 (0.46) ACE2CES2CES1LMNAMEN1
SCHEMBL7743511 0.88 ACE2 (0.40) ACE2CES2CES1LMNAMEN1
SCHEMBL31521496 0.87 MAPT (0.39) ACE2CES2CES1DNM1LMNA

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