SCHEMBL8919040

SCHEMBL8919040

CCCc1cc(C(=O)O)cc2ccc(=O)[nH]c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.38
PDE2A O00408 1/20 0.38
PDE1A P54750 1/20 0.38
PDE1B Q01064 1/20 0.38
PDE1C Q14123 1/20 0.38
GPR35 Q9HC97 1/20 0.38
HRH3 Q9Y5N1 1/20 0.37
MPL P40238 1/20 0.37
ADORA2B P29275 2/20 0.36
ADORA3 P0DMS8 1/20 0.36
EIF4A3 P38919 1/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
DAO P14920 2/20 0.35
KDM4E B2RXH2 1/20 0.35
PSMD14 O00487 1/20 0.35
RECQL P46063 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
RXRA P19793 1/20 0.35

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
SCHEMBL8921146 0.90 DAO (0.41) GPR35HRH3ADORA2BADORA3EIF4A3
SCHEMBL8919223 0.85 THRA (0.37) PPARGDAOKDM4EPDE3BPDE3A
SCHEMBL1144962 0.77 MEN1 (0.41) GPR35HRH3EIF4A3MEN1KMT2A
SCHEMBL8919196 0.75 CA12 (0.50) KDM4EALDH1A1HPGDCNR2
SCHEMBL8918029 0.74 DAO (0.38) DAOKDM4EALDH1A1HPGDHSD17B10
SCHEMBL8919183 0.74 CHEK1 (0.43) PPARGMEN1KMT2ADAOKDM4E
SCHEMBL8919071 0.74 EIF4A3 (0.54) GPR35EIF4A3MEN1KMT2AKDM4E
SCHEMBL27787365 0.72 TPMT (0.46) PPARGGPR35KDM4EPSMD14RECQL
SCHEMBL8921004 0.72 CA12 (0.51) KMT2ADAOKDM4EPDE3BPDE3A
SCHEMBL7840002 0.70 GPR84 (0.47) PPARGMEN1KMT2AKDM4ETDP1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5591751-A CARBOSTYRIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1997-01-07 US disclosed
EP-0636128-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-02-01 EP disclosed
WO-1994019339-A1 PIPERAZINOCARBONYLCARBOSTYRILS AS PERIPHERAL VASODILATORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1994-09-01 WO disclosed