SCHEMBL6662072

SCHEMBL6662072

CCCCCCCCCCCCCC(CC)[S+]([O-])C(CC)CCCCCCCCCCCCC

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
DNM1 Q05193 2/20 0.39
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.38
CA2 P00918 1/20 0.38
OPRM1 P35372 1/20 0.37
ACE2 Q9BYF1 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GPR84 Q9NQS5 3/20 0.35
FDPS P14324 3/20 0.35
SPHK1 Q9NYA1 1/20 0.35
FFAR1 O14842 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
SCHEMBL7104457 0.98 OPRM1 (0.39) LMNADNM1TSHRTHRBCA2
SCHEMBL4131700 0.90 ALDH1A1 (0.37) DNM1TSHRCA2ALDH1A1FDPS
SCHEMBL11449395 0.90 LMNA (0.47) LMNATSHRCA2ACE2ALDH1A1
SCHEMBL4362883 0.88 DNM1 (0.46) LMNADNM1TSHRTHRBCA2
SCHEMBL31578848 0.84 LMNA (0.38) LMNADNM1TSHRTHRBCA2
SCHEMBL11385298 0.84 LMNA (0.38) LMNADNM1TSHRTHRBCA2
SCHEMBL9642329 0.82 LMNA (0.52) LMNATSHRCA2ACE2ALDH1A1
SCHEMBL4315318 0.82 LMNA (0.52) LMNATSHRCA2ACE2ALDH1A1
SCHEMBL11889656 0.80 OPRM1 (0.38) LMNADNM1TSHRTHRBCA2
SCHEMBL8585546 0.80 LMNA (0.45) LMNATSHRCA2OPRM1ACE2

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-2004018608-A1 PROCESS FOR DETERGENT BAR MANUFACTURE UNILEVER N.V. (NL) 2004-03-04 WO disclosed