SCHEMBL19210500

SCHEMBL19210500

Cc1ccc(-c2csc(COc3ccc(F)c(C(N)=O)c3F)n2)cn1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 6/20 0.43
PPARD Q03181 4/20 0.43
POLB P06746 1/20 0.43
PPARA Q07869 2/20 0.42
RAB9A P51151 5/20 0.42
NPC1 O15118 2/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
ALDH1A1 P00352 3/20 0.41
MEN1 O00255 3/20 0.40
TDP1 Q9NUW8 1/20 0.40
MAPT P10636 3/20 0.37
KDM4E B2RXH2 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
APEX1 P27695 1/20 0.37
RECQL P46063 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL2707296 0.90 RAB9A (0.54) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL19210502 0.88 PPARD (0.43) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL204423 0.87 L3MBTL1 (0.45) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL2705816 0.87 L3MBTL1 (0.53) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL19210476 0.87 PPARD (0.42) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL2704589 0.86 PPARD (0.52) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL203280 0.86 L3MBTL1 (0.59) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL201521 0.85 PPARD (0.49) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL201928 0.85 NPC1 (0.38) L3MBTL1PPARDPOLBPPARARAB9A
SCHEMBL19471075 0.84 L3MBTL1 (0.42) L3MBTL1PPARDPOLBPPARARAB9A

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