SCHEMBL20065637

SCHEMBL20065637

C=CCCCCCCCCCOP(=O)(OCCCCCCCC=C)OCCCCCCCCCC=C

nearest known ligand 0.70

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LPAR3 Q9UBY5 9/20 0.70
LPAR2 Q9HBW0 6/20 0.70
CYP3A4 P08684 2/20 0.44
TSHR P16473 3/20 0.41
LPAR1 Q92633 4/20 0.40
ABCC4 O15439 1/20 0.40
MAPT P10636 1/20 0.40
ALDH1A1 P00352 4/20 0.39
LMNA P02545 1/20 0.39
SLC2A1 P11166 1/20 0.33
TRPA1 O75762 1/20 0.33

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
SCHEMBL11322955 1.00 LPAR3 (0.70) LPAR3LPAR2CYP3A4TSHRLPAR1
SCHEMBL17975103 1.00 LPAR3 (0.70) LPAR3LPAR2CYP3A4TSHRLPAR1
SCHEMBL16581542 0.98 LPAR3 (0.67) LPAR3LPAR2CYP3A4TSHRLPAR1
SCHEMBL21549830 0.91 LPAR3 (0.66) LPAR3LPAR2CYP3A4TSHRLPAR1
SCHEMBL30695104 0.90 LPAR3 (0.59) LPAR3LPAR2CYP3A4TSHRLPAR1
SCHEMBL193734 0.83 LPAR3 (0.56) LPAR3LPAR2CYP3A4TSHRLPAR1
SCHEMBL9661964 0.83 LPAR3 (1.00) LPAR3LPAR2TSHRLPAR1ABCC4
SCHEMBL192861 0.83 LPAR3 (1.00) LPAR3LPAR2TSHRLPAR1ABCC4
SCHEMBL21443890 0.83 LPAR3 (0.78) LPAR3LPAR2TSHRLPAR1ABCC4
SCHEMBL4968805 0.83 LPAR3 (1.00) LPAR3LPAR2TSHRLPAR1ABCC4

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
US-20180106785-A1 CAPSULE SUITABLE FOR NON-INVASIVE SIMULTANEOUS OXYGEN CONTENT AND TEMPERATURE SENSING IN A LIVING OBJECT MAX-PLANCK-GESELLSCHAFT ZUR FORDERUNG DER WISSENSCHAFTEN E.V. (DE) 2018-04-19 US disclosed