SCHEMBL28069774

SCHEMBL28069774

COC(=O)c1cccc2c1ccn2F

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 3/20 0.50
KMT2A Q03164 8/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 3/20 0.48
ALDH1A1 P00352 3/20 0.45
HSP90AA1 P07900 1/20 0.45
KDM4E B2RXH2 2/20 0.44
THRB P10828 1/20 0.44
GAA P10253 1/20 0.44
MYC P01106 1/20 0.44
LMNA P02545 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
CFTR P13569 1/20 0.42
HSD17B10 Q99714 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL701556 0.82 NR4A2 (0.64) NR4A2KMT2AMAPTMEN1ALDH1A1
SCHEMBL31607540 0.82 NR4A2 (0.64) NR4A2KMT2AMAPTMEN1ALDH1A1
SCHEMBL3222576 0.81 NR4A2 (0.50) NR4A2KMT2AMAPTMEN1ALDH1A1
SCHEMBL11218801 0.81 NR4A2 (0.50) NR4A2KMT2AMAPTMEN1ALDH1A1
SCHEMBL28280848 0.81 NR4A2 (0.50) NR4A2KMT2AMAPTMEN1ALDH1A1
SCHEMBL27988729 0.80 NR4A1 (0.46) NR4A2ALDH1A1KDM4ESMN1; SMN2TSHR
SCHEMBL15999018 0.79 NR4A2 (0.52) NR4A2KMT2AMAPTMEN1ALDH1A1
SCHEMBL15558170 0.79 NR4A2 (0.69) NR4A2KMT2AMAPTMEN1ALDH1A1
SCHEMBL7507425 0.78 NR4A2 (0.48) NR4A2KMT2AMAPTMEN1ALDH1A1
SCHEMBL13824516 0.78 NR4A2 (0.67) NR4A2KMT2AMAPTMEN1ALDH1A1

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
CN-105593211-A Indol and indazol derivatives HOFFMANN LA ROCHE 2016-05-18 CN disclosed