SCHEMBL19210476

SCHEMBL19210476

NC(=O)c1c(F)ccc(OCc2nc(-c3cnc(Cl)nc3)cs2)c1F

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 4/20 0.42
L3MBTL1 Q9Y468 5/20 0.40
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
POLB P06746 1/20 0.40
CASP3 P42574 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
MAPT P10636 5/20 0.37
ALDH1A1 P00352 4/20 0.37
MEN1 O00255 3/20 0.37
GAA P10253 1/20 0.37
KMT2A Q03164 1/20 0.37
PPARA Q07869 2/20 0.37
EPHA2 P29317 1/20 0.36
KDR P35968 1/20 0.36
EPHB4 P54760 1/20 0.36
LMNA P02545 2/20 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
SCHEMBL19210502 0.91 PPARD (0.43) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL2704589 0.89 PPARD (0.52) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL19210500 0.87 L3MBTL1 (0.43) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL201521 0.86 PPARD (0.49) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL204423 0.86 L3MBTL1 (0.45) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL2705816 0.86 L3MBTL1 (0.53) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL2707296 0.84 RAB9A (0.54) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL17275085 0.84 EPHA2 (0.46) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL201734 0.83 PPARD (0.51) PPARDL3MBTL1RAB9ANPC1TDP1
SCHEMBL17275068 0.83 NPC1 (0.38) PPARDL3MBTL1RAB9ANPC1TDP1

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-2699557-B1 3-(OXAZOL-2-YL-ETHOXY)- AND 3-(THIAZOL-2-YL-ETHOXY)-BENZAMIDE DERIVATIVES AS ANTI-BACTERIAL AGENTS BIOTA SCIENT MANAGEMENT (AU) 2017-08-16 EP disclosed