SCHEMBL7103133

SCHEMBL7103133

CCc1nc2cc(F)ccc2n1C(CC(C)C(=O)O)c1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.39
AGTR2 P50052 1/20 0.39
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GAA P10253 1/20 0.37
TBXA2R P21731 4/20 0.37
HDAC6 Q9UBN7 1/20 0.37
PPARG P37231 2/20 0.36
RXFP1 Q9HBX9 1/20 0.36
TP53 P04637 1/20 0.36
SAE1 Q9UBE0 1/20 0.36
UBA2 Q9UBT2 1/20 0.36
CPT1A P50416 1/20 0.35
RAB9A P51151 1/20 0.35
APAF1 O14727 1/20 0.35
ALOX5AP P20292 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
SCHEMBL7098112 0.92 AGTR1 (0.41) AGTR1AGTR2MEN1KMT2AGAA
SCHEMBL7100111 0.87 BACE1 (0.43) MEN1KMT2ATBXA2RPPARGAPAF1
SCHEMBL7100218 0.87 KDM4E (0.39) MEN1KMT2AHDAC6PPARGAPAF1
SCHEMBL7102086 0.87 APAF1 (0.47) MEN1KMT2AHDAC6TP53APAF1
SCHEMBL7096854 0.85 APAF1 (0.39) GAAHDAC6PPARGAPAF1
SCHEMBL7096051 0.84 PPARG (0.43) AGTR1AGTR2HDAC6PPARGAPAF1
SCHEMBL7097769 0.84 KMT2A (0.44) MEN1KMT2ARAB9A
SCHEMBL6426492 0.82 APAF1 (0.40) MEN1KMT2AAPAF1
SCHEMBL7097958 0.80 PPARG (0.38) MEN1KMT2APPARG
SCHEMBL7099617 0.79 TP53 (0.43) MEN1KMT2APPARGTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1326864-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2003-07-16 EP disclosed
WO-2002032900-A2 ARYL OR HETEROARYL FUSED IMIDAZOLE COMPOUNDS AS ANTI-INFLAMMATORY AND ANALGESIC AGENTS PFIZER PHARMACEUTICALS INC. (JP) 2002-04-25 WO disclosed