SCHEMBL28624965

SCHEMBL28624965

CCc1cc(-c2nc(C)c(CBr)s2)ccn1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SREBF2 Q12772 12/20 0.50
CDC7 O00311 1/20 0.50
DBF4 Q9UBU7 1/20 0.50
SREBF1 P36956 1/20 0.50
MAPT P10636 3/20 0.39
ATM Q13315 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ALDH1A1 P00352 1/20 0.39
KDM4E B2RXH2 2/20 0.38
LMNA P02545 2/20 0.38
RECQL P46063 1/20 0.38
MTOR P42345 1/20 0.37
MAP4K4 O95819 1/20 0.37
CDK5 Q00535 1/20 0.36
CDK5R1 Q15078 1/20 0.36
PDE10A Q9Y233 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
SCHEMBL27953559 0.89 CDC7 (0.48) SREBF2CDC7DBF4SREBF1MAPT
SCHEMBL27943071 0.80 CDC7 (0.46) SREBF2CDC7DBF4SREBF1MAPT
SCHEMBL27953527 0.80 CDC7 (0.43) SREBF2CDC7DBF4SREBF1MAPT
SCHEMBL27942959 0.79 CDC7 (0.44) SREBF2CDC7DBF4SREBF1MAPT
SCHEMBL27858910 0.78 CDC7 (0.46) SREBF2CDC7DBF4SREBF1MAPT
SCHEMBL27942962 0.78 CDC7 (0.46) SREBF2CDC7DBF4SREBF1
SCHEMBL27942928 0.78 FFAR1 (0.49) SREBF2CDC7DBF4SREBF1MAPT
SCHEMBL27942915 0.78 FFAR1 (0.55) SREBF2CDC7DBF4SREBF1MAPT
Bromobenzene SCHEMBL27953553 0.78 CDC7 (0.46) SREBF2CDC7DBF4SREBF1MAPT
SCHEMBL14840661 0.77 CDC7 (0.62) SREBF2CDC7DBF4SREBF1MAPT

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-113149980-A Tert-butyloxycarbonyl micromolecule organic compound targeting PUF60, derivative thereof and application thereof 上海市奉贤区中心医院 2021-07-23 CN disclosed