SCHEMBL3889293

SCHEMBL3889293

Cc1ccccc1COc1ccc(CC(C)C(=O)O)cc1-c1ccc2[nH]ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGER1 P34995 2/20 0.46
PTGER4 P35408 2/20 0.46
PTGER3 P43115 2/20 0.46
PTGER2 P43116 2/20 0.46
ENPP2 Q13822 1/20 0.43
PTGS2 P35354 1/20 0.41
NOTUM Q6P988 1/20 0.41
CD274 Q9NZQ7 9/20 0.40
FFAR1 O14842 2/20 0.40
PDCD1 Q15116 1/20 0.40
PLA2G10 O15496 3/20 0.38
PLA2G2A P14555 3/20 0.38
PLA2G1B P04054 1/20 0.38
PLA2G5 P39877 1/20 0.38
PLA2G2C Q5R387 1/20 0.38
PLA2G12B Q9BX93 1/20 0.38
PLA2G12A Q9BZM1 1/20 0.38
PLA2G2F Q9BZM2 1/20 0.38
PLA2G3 Q9NZ20 1/20 0.38
PLA2G2E Q9NZK7 1/20 0.38

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
SCHEMBL3886886 0.91 PTGER1 (0.41) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3887505 0.90 PTGER1 (0.46) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3886829 0.90 PTGER1 (0.46) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3885225 0.90 PTGER1 (0.46) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3890174 0.90 PTGER1 (0.53) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3894953 0.89 PTGER1 (0.47) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3884238 0.89 PTGER1 (0.52) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3884663 0.88 FFAR1 (0.45) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3886278 0.87 PTGER1 (0.45) PTGER1PTGER4PTGER3PTGER2ENPP2
SCHEMBL3882397 0.87 PTGER1 (0.44) PTGER1PTGER4PTGER3PTGER2ENPP2

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
EP-1477472-B1 SUBSTITUTED PHENYLALKANOIC ACID DERIVATIVE AND USE THEREOF ASAHI KASEI PHARMA CORP (JP) 2009-01-14 EP claimed