SCHEMBL8475168

SCHEMBL8475168

CCCc1[c]nc(OC)c(-c2ccc(OC)c(C)c2)c1-c1ccc(OC)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.39
MAPT P10636 2/20 0.36
KDM4E B2RXH2 2/20 0.36
PDGFRB P09619 1/20 0.36
PDGFRA P16234 1/20 0.36
PTGS2 P35354 3/20 0.33
PTGS1 P23219 1/20 0.33
GRK6 P43250 1/20 0.32
CRHR1 P34998 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MEN1 O00255 1/20 0.32
RECQL P46063 1/20 0.32
KMT2A Q03164 1/20 0.32
ALOX5 P09917 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
TAS1R3 Q7RTX0 1/20 0.32
TAS1R1 Q7RTX1 1/20 0.32
S1PR1 P21453 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
SCHEMBL8478576 0.90 KDM4E (0.37) MAPK1MAPTKDM4EPDGFRBPDGFRA
SCHEMBL8474084 0.89 S1PR1 (0.37) MAPK1MAPTKDM4EPDGFRBPDGFRA
SCHEMBL8474672 0.82 NPC1 (0.34) MAPTKDM4EALDH1A1KMT2A
SCHEMBL8474956 0.81 KDM4E (0.40) MAPTKDM4EPDGFRBPDGFRAPTGS2
SCHEMBL8475225 0.80 MAPT (0.44) MAPTKDM4EPTGS2
SCHEMBL8583542 0.77 KDM4E (0.41) MAPK1MAPTKDM4EPDGFRBPDGFRA
SCHEMBL8480427 0.73 PTGS2 (0.39) MAPK1MAPTKDM4EPDGFRBPDGFRA
SCHEMBL8479043 0.73 MAPK1 (0.37) MAPK1MAPTKDM4EPDGFRBPDGFRA
SCHEMBL8581095 0.72 MAPK1 (0.36) MAPK1MAPTKDM4EPDGFRBPDGFRA
SCHEMBL8475140 0.72 PTGS2 (0.36) MAPK1MAPTKDM4EPDGFRBPDGFRA

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