SCHEMBL28295521

SCHEMBL28295521

Cc1nc(-c2ccc(Br)cc2)sc1C(=O)OCCO

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 4/20 0.57
DBF4 Q9UBU7 4/20 0.57
MAPT P10636 5/20 0.50
KDM4E B2RXH2 4/20 0.50
DHODH Q02127 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
POLB P06746 2/20 0.49
TRPM8 Q7Z2W7 4/20 0.48
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
RAB9A P51151 3/20 0.48
GAA P10253 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.45
TARBP2 Q15633 1/20 0.44

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
SCHEMBL28297235 0.88 CDC7 (0.59) CDC7DBF4MAPTKDM4EPOLB
SCHEMBL4464882 0.88 CDC7 (0.73) CDC7DBF4MAPTKDM4EDHODH
SCHEMBL28295570 0.87 SMN1; SMN2 (0.63) CDC7DBF4MAPTKDM4EPOLB
SCHEMBL28295659 0.87 CDC7 (0.57) CDC7DBF4MAPTKDM4ENPSR1
SCHEMBL28297329 0.84 CDC7 (0.60) CDC7DBF4MAPTKDM4ENPSR1
SCHEMBL28297323 0.84 MEN1 (0.64) CDC7DBF4MAPTKDM4EALDH1A1
SCHEMBL28297249 0.84 CDC7 (0.53) CDC7DBF4MAPTKDM4EDHODH
SCHEMBL28295554 0.83 RAB9A (0.66) CDC7DBF4MAPTKDM4EPOLB
SCHEMBL8345120 0.82 MAPT (0.57) CDC7DBF4MAPTKDM4EDHODH
SCHEMBL28295517 0.81 CDC7 (0.51) CDC7DBF4MAPTKDM4EDHODH

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-109810071-A A kind of miRNA biosynthesis inhibitor 中国科学院成都生物研究所 2019-05-28 CN disclosed