SCHEMBL8475140

SCHEMBL8475140

CCCc1[c]cc(-c2ccc(OC)c(C)c2)c(-c2ccc(OC)c(C)c2)c1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 4/20 0.36
GABRA1 P14867 2/20 0.36
GABRB2 P47870 2/20 0.36
ALOX5 P09917 1/20 0.36
MAPK1 P28482 1/20 0.36
PTGS1 P23219 2/20 0.36
GABRA5 P31644 1/20 0.34
GABRA3 P34903 1/20 0.34
GABRA2 P47869 1/20 0.34
KDM4E B2RXH2 1/20 0.33
MAPT P10636 1/20 0.33
PDGFRB P09619 1/20 0.33
PDGFRA P16234 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
PDCD1 Q15116 1/20 0.32
CD274 Q9NZQ7 1/20 0.32
GRM2 Q14416 1/20 0.31
SLC10A2 Q12908 1/20 0.31
HTR2C P28335 1/20 0.31

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
SCHEMBL8477928 0.89 PTGS2 (0.38) PTGS2GABRA1GABRB2ALOX5PTGS1
SCHEMBL8480427 0.81 PTGS2 (0.39) PTGS2GABRA1GABRB2ALOX5MAPK1
SCHEMBL8481674 0.81 PTGS2 (0.37) PTGS2PTGS1KDM4EMAPTPDGFRB
SCHEMBL8474934 0.79 BCL2L2 (0.33) PTGS2GABRA1GABRB2ALOX5MAPK1
SCHEMBL8479043 0.78 MAPK1 (0.37) PTGS2GABRA1GABRB2ALOX5MAPK1
SCHEMBL8474261 0.78 MGAM (0.42) MAPK1KDM4EMAPT
SCHEMBL8476218 0.75 GCGR (0.33)
SCHEMBL8474110 0.72 GCGR (0.35) KDM4EMAPTPDCD1CD274
SCHEMBL8581095 0.72 MAPK1 (0.36) PTGS2GABRA1GABRB2ALOX5MAPK1
SCHEMBL8581223 0.72 MAPK1 (0.36) PTGS2GABRA1GABRB2ALOX5MAPK1

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-6004988-A Carboxylic acid derivatives, their preparation and their use BASF AKTIENGESELLSCHAFT (DE) 1999-12-21 US disclosed