SCHEMBL33377367

SCHEMBL33377367

O=C1N=Cc2cccc(F)c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
CA7 P43166 1/20 0.36
CA9 Q16790 1/20 0.36
SRD5A1 P18405 1/20 0.33
TTR P02766 1/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
RAB9A P51151 1/20 0.33
CES2 O00748 1/20 0.32
CES1 P23141 1/20 0.32
F7 P08709 1/20 0.31
F3 P13726 1/20 0.31
PARP1 P09874 2/20 0.31
TYK2 P29597 2/20 0.31
MAPK14 Q16539 1/20 0.30
JAK2 O60674 1/20 0.30
JAK1 P23458 1/20 0.30
HTT P42858 1/20 0.30
NOD2 Q9HC29 1/20 0.30

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
SCHEMBL1612080 0.75 ADORA2A (0.39) PARP1
SCHEMBL9949417 0.75 NPC1 (0.33) NPC1LMNARAB9A
SCHEMBL31310158 0.75 PARP1 (0.36) LMNACES1PARP1HTT
SCHEMBL28983763 0.71 ENPP2 (0.31)
SCHEMBL31272464 0.69 S100A4 (0.50) CA1CA2CA7CA9
SCHEMBL29960521 0.68
SCHEMBL28983718 0.68
SCHEMBL29096395 0.65 CA9 (0.42) CA1CA2CA7CA9SRD5A1
SCHEMBL30459618 0.64 KDM4E (0.31)
SCHEMBL113314 0.64 GSK3B (0.40) NPC1LMNARAB9ACES2CES1

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-3768675-B1 NOVEL TRIAZOLONE DERIVATIVES OR SALTS THEREOF AND PHARMACEUTICAL COMPOSITIONS COMPRISING THE SAME YUHAN CORP (KR) 2026-04-01 EP claimed