SCHEMBL8993313

SCHEMBL8993313

CC1c2cc(Cl)ccc2-c2ccc(Cl)c(CCC(=O)O)c21

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 7/20 0.40
GPR17 Q13304 1/20 0.40
PPARG P37231 1/20 0.39
PTGDR2 Q9Y5Y4 3/20 0.38
KDM4E B2RXH2 2/20 0.37
HPGD P15428 2/20 0.37
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
ALDH1A1 P00352 2/20 0.36
TP53 P04637 1/20 0.36
FFAR4 Q5NUL3 2/20 0.35
HDAC6 Q9UBN7 1/20 0.35
SLC22A12 Q96S37 1/20 0.35
MAPT P10636 1/20 0.35
PKM P14618 1/20 0.35
HTT P42858 1/20 0.35
GFER P55789 1/20 0.35
PTGDR Q13258 1/20 0.34

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
SCHEMBL8993268 0.69 HSP90AA1 (0.53) FFAR1GPR17PPARGKDM4EHPGD
SCHEMBL30633032 0.68 S100A4 (0.41) TP53HTT
SCHEMBL8993316 0.68 S100A4 (0.41) TP53HTT
SCHEMBL32689799 0.66 FFAR1 (0.49) FFAR1GPR17RXRARXRBALDH1A1
SCHEMBL4699761 0.66 FFAR1 (0.49) FFAR1GPR17RXRARXRBALDH1A1
SCHEMBL1590066 0.63 GPR17 (0.57) FFAR1GPR17RXRARXRBFFAR4
SCHEMBL2109135 0.63 AKR1B1 (0.63) FFAR1GPR17KDM4ESLC22A12
SCHEMBL30567601 0.63 PDPK1 (0.59) FFAR1GPR17PPARGHPGDALDH1A1
SCHEMBL586345 0.63 PDPK1 (0.59) FFAR1GPR17PPARGHPGDALDH1A1
SCHEMBL2687868 0.62 CYP2A6 (0.40) ALDH1A1MAPTHTT

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-5519043-A ANTIINFLAMMATORY AGENTS WITH AMIDE, CARBAMATE OR THIOCARBAMATE GROUPS ON FLUORENE AND BENZENE SCIOS NOVA INC. (US) 1996-05-21 US disclosed
US-5472973-A Non-steroidal antiinflammatory agents SCIOS NOVA INC. (US) 1995-12-05 US disclosed
WO-1993011764-A1 FLUORENYL DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS SCIOS NOVA INC. (US) 1993-06-24 WO disclosed