SCHEMBL25436722

SCHEMBL25436722

CCCCC/C=C\CCCCCCCCCCCOc1cn(C)cc1OCCCCCCCC

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.46
LPAR1 Q92633 1/20 0.44
LPAR2 Q9HBW0 1/20 0.44
LPAR3 Q9UBY5 1/20 0.44
FAAH O00519 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41

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
SCHEMBL25436719 1.00 MGLL (0.46) MGLLLPAR1LPAR2LPAR3FAAH
SCHEMBL541249 0.72 FAAH (0.70) FAAH
SCHEMBL44028 0.71 LPAR1 (0.57) LPAR1LPAR2LPAR3FAAH
SCHEMBL21924992 0.71 LPAR1 (0.57) LPAR1LPAR2LPAR3FAAH
SCHEMBL4448701 0.71 LPAR1 (0.57) LPAR1LPAR2LPAR3FAAH
SCHEMBL1712717 0.71 LPAR2 (0.57) LPAR1LPAR2LPAR3FAAH
SCHEMBL9751861 0.71 LPAR2 (0.57) LPAR1LPAR2LPAR3FAAH
SCHEMBL24398977 0.71 LPAR1 (0.57) LPAR1LPAR2LPAR3FAAH
SCHEMBL20774497 0.71 LPAR1 (0.57) LPAR1LPAR2LPAR3FAAH
SCHEMBL29421860 0.71 LPAR1 (0.57) LPAR1LPAR2LPAR3FAAH

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-2023137550-A1 COMPOSITIONS AND METHODS FOR THE PREVENTION AND/OR TREATMENT OF COVID-19 PROVIDENCE THERAPEUTICS HOLDINGS INC. (CA) 2023-07-27 WO disclosed