SCHEMBL30536621

SCHEMBL30536621

COCOc1ccc2cn[nH]c2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 7/20 0.52
FGFR2 P21802 5/20 0.52
FGFR3 P22607 2/20 0.52
KDM4E B2RXH2 5/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 3/20 0.47
F2 P00734 1/20 0.47
DYRK1A Q13627 3/20 0.46
NOS1 P29475 2/20 0.46
HTT P42858 2/20 0.46
METAP2 P50579 2/20 0.46
MEN1 O00255 1/20 0.46
PKM P14618 1/20 0.46
KMT2A Q03164 1/20 0.46
APAF1 O14727 1/20 0.43
HSD17B10 Q99714 1/20 0.43
DRD2 P14416 2/20 0.42
MAOB P27338 1/20 0.41
PIK3CD O00329 1/20 0.41
PIK3CA P42336 1/20 0.41

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
SCHEMBL26660931 1.00 FGFR1 (0.52) FGFR1FGFR2FGFR3KDM4EMAPT
SCHEMBL4978879 0.86 FGFR1 (0.51) FGFR1FGFR2FGFR3KDM4EMAPT
SCHEMBL31134083 0.86 FGFR1 (0.51) FGFR1FGFR2FGFR3KDM4EMAPT
SCHEMBL16711152 0.83 FGFR2 (0.71) FGFR1FGFR2FGFR3KDM4EMAPT
SCHEMBL31052754 0.81 KDM4E (0.60) FGFR1FGFR2FGFR3KDM4EMAPT
SCHEMBL252796 0.81 KDM4E (0.60) FGFR1FGFR2FGFR3KDM4EMAPT
Hydrochloric Acid SCHEMBL29920009 0.80 KDM4E (0.58) FGFR1FGFR2FGFR3KDM4EMAPT
SCHEMBL18639993 0.79 MAOB (0.58) FGFR1FGFR2FGFR3KDM4EMAPT
SCHEMBL6702968 0.79 FGFR1 (0.71) FGFR1FGFR2FGFR3DYRK1AMAOB
SCHEMBL28738120 0.77 SYK (0.51) FGFR1FGFR2FGFR3KDM4EMAPT

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-116600801-A HSD17B13 inhibitors and uses thereof FL2022-001公司 2023-08-15 CN disclosed