SCHEMBL28633833

SCHEMBL28633833

Cc1nn(OC(=O)N2CCCCC2)cc1Br

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 7/20 0.39
ALDH1A1 P00352 4/20 0.39
NPSR1 Q6W5P4 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
TSHR P16473 3/20 0.38
GAA P10253 2/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
NPC1 O15118 4/20 0.37
RAB9A P51151 4/20 0.37
MAPT P10636 3/20 0.37
LMNA P02545 1/20 0.37
ATM Q13315 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
RXFP1 Q9HBX9 1/20 0.36
HTT P42858 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL5648948 0.73 SMN1; SMN2 (0.41) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL5649629 0.73 ALDH1A1 (0.45) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL29014071 0.71 NPC1 (0.53) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL28751123 0.67 ALDH1A1 (0.41) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL5648255 0.67 ALDH1A1 (0.41) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL5650999 0.67 ALDH1A1 (0.41) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL5645448 0.66 ALDH1A1 (0.40) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL5650293 0.65 ALDH1A1 (0.42) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL28650726 0.65 ALDH1A1 (0.39) HPGDALDH1A1NPSR1MEN1KMT2A
SCHEMBL28995960 0.65 SMN1; SMN2 (0.44) HPGDALDH1A1NPSR1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113490666-A Substituted pyrazolo [1,5-A ] pyridine compounds as inhibitors of FGFR tyrosine kinases 奥瑞生物药品公司 2021-10-08 CN disclosed
CN-113474337-A 7- ((3, 5-dimethoxyphenyl) amino) quinoxaline derivatives as FGFR inhibitors for the treatment of cancer 奥瑞生物药品公司 2021-10-01 CN disclosed