SCHEMBL7744228

SCHEMBL7744228

C=C(CCCCCCC)CC(C)CCCC

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.40
DNM1 Q05193 2/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
FAAH O00519 1/20 0.37
MAPK1 P28482 1/20 0.37
CES2 O00748 3/20 0.37
CES1 P23141 3/20 0.37
FFAR4 Q5NUL3 2/20 0.36
FFAR1 O14842 2/20 0.36
PPARG P37231 4/20 0.35
PPARD Q03181 4/20 0.35
PPARA Q07869 4/20 0.35
TSHR P16473 3/20 0.35
GPR84 Q9NQS5 3/20 0.35
HDAC11 Q96DB2 3/20 0.35
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
SLC22A6 Q4U2R8 1/20 0.35

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
SCHEMBL7743672 0.96 ACE2 (0.44) ACE2LMNAMEN1KMT2AFAAH
SCHEMBL7743761 0.96 ACE2 (0.44) ACE2LMNAMEN1KMT2AFAAH
SCHEMBL7743773 0.92 TSHR (0.38) ACE2LMNAMEN1KMT2AFAAH
SCHEMBL26977437 0.89 LMNA (0.38) ACE2LMNAMEN1KMT2AFAAH
SCHEMBL26977248 0.86 SMN1; SMN2 (0.36) ACE2LMNAMEN1KMT2AFAAH
SCHEMBL23923682 0.86 ACE2 (0.50) ACE2DNM1LMNAMEN1KMT2A
SCHEMBL7744145 0.86 LMNA (0.38) LMNAMEN1KMT2AFAAHMAPK1
SCHEMBL7744146 0.85 LMNA (0.41) ACE2LMNAMEN1KMT2AGPR84
SCHEMBL23567507 0.85 SPHK1 (0.37) DNM1MEN1KMT2ATSHRALDH1A1
SCHEMBL8746955 0.84 MEN1 (0.41) LMNAMEN1KMT2AFAAHMAPK1

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