SCHEMBL30189265

SCHEMBL30189265

O=C(O)c1cc(F)cc(-c2cccc(F)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMO O15229 3/20 0.53
DHODH Q02127 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CES2 O00748 1/20 0.52
CES1 P23141 1/20 0.52
RXRA P19793 1/20 0.51
RXRB P28702 1/20 0.51
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
DCLRE1B Q9H816 1/20 0.50
HCAR1 Q9BXC0 1/20 0.50
AXL P30530 1/20 0.50
SYK P43405 1/20 0.50
PARP1 P09874 1/20 0.48

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
SCHEMBL2160048 1.00 KMO (0.53) KMODHODHL3MBTL1CES2CES1
SCHEMBL3210250 0.94 KMO (0.60) KMODHODHL3MBTL1RXRARXRB
SCHEMBL121809 0.89 KMO (0.68) KMOCES2CES1RXRARXRB
SCHEMBL122522 0.89 DHODH (0.59) KMODHODHHCAR1AXL
SCHEMBL410738 0.87 KMO (0.66) KMODHODHRXRARXRBDCLRE1B
SCHEMBL29784144 0.87 KMO (0.66) KMODHODHRXRARXRBDCLRE1B
SCHEMBL3211056 0.87 DHODH (0.62) KMODHODHHCAR1AXL
SCHEMBL14783757 0.86 DHODH (0.57) KMODHODHRXRARXRBNR4A1
SCHEMBL2557078 0.86 KMO (0.51) KMODHODHRXRARXRBHCAR1
SCHEMBL2554588 0.84 TRIM24 (0.65) KMODHODHRXRARXRBHCAR1

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
EP-4149945-A1 SUBSTITUTED TRICYCLIC AMIDES, ANALOGUES THEREOF, AND METHODS USING SAME Arbutus Biopharma Corporation (CA) 2023-03-22 EP disclosed