SCHEMBL4318565

SCHEMBL4318565

NC(=O)Oc1ccc(O)cc1F

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
SLC2A1 P11166 1/20 0.37
SLC2A4 P14672 1/20 0.37
LMNA P02545 3/20 0.37
HTT P42858 2/20 0.37
MAPK1 P28482 1/20 0.37
RAB9A P51151 1/20 0.37
ESR1 P03372 6/20 0.36
ESR2 Q92731 5/20 0.36
CHRNA7 P36544 1/20 0.35
PARP1 P09874 1/20 0.34
CYP1A2 P05177 1/20 0.33

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
SCHEMBL3643699 0.85 CYP4F2 (0.41) MIFMEN1KMT2ASLC2A1SLC2A4
SCHEMBL6172318 0.82 CES2 (0.45) MEN1KMT2AMAPK1CYP1A2
SCHEMBL27621487 0.81 MEN1 (0.39) MEN1KMT2ALMNAHTTMAPK1
SCHEMBL12987528 0.81 CYP4F2 (0.49) MIFLMNAHTTMAPK1RAB9A
SCHEMBL28615189 0.79 MAP2K1 (0.42) MEN1KMT2ALMNAHTTMAPK1
SCHEMBL27984901 0.79 MRGPRX4 (0.44) MEN1KMT2ALMNAHTTMAPK1
SCHEMBL5197975 0.79 DGAT1 (0.55) MEN1KMT2ALMNAHTTRAB9A
SCHEMBL18115522 0.79 PPARG (0.50) KMT2A
SCHEMBL767991 0.78 SLC2A1 (0.49) MEN1KMT2ASLC2A1SLC2A4LMNA
SCHEMBL6316992 0.78 CARM1 (0.39) MIFSLC2A1SLC2A4LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114920703-B Quinazoline derivative and preparation method and application thereof 天津济坤医药科技有限公司 2024-01-09 CN disclosed
CN-114920703-A Quinazoline derivative and preparation method and application thereof 天津济坤医药科技有限公司 2022-08-19 CN disclosed
CN-112334460-A Biaryl ether type quinazoline derivative 第一三共株式会社 2021-02-05 CN disclosed
WO-2020009156-A1 BIARYL ETHER-TYPE QUINAZOLINE DERIVATIVE 第一三共株式会社 2020-01-09 WO disclosed
WO-2009136663-A1 FUSED HETEROCYCLIC DERIVATIVES AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-11-12 WO disclosed