SCHEMBL28566243

SCHEMBL28566243

Brc1ccc(-c2cccc(I)c2)nc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 2/20 0.49
HSD17B1 P14061 2/20 0.42
HSD17B2 P37059 2/20 0.42
IDO1 P14902 2/20 0.38
PLK4 O00444 1/20 0.37
AURKA O14965 1/20 0.37
JAK2 O60674 1/20 0.37
ROCK2 O75116 1/20 0.37
PRKD3 O94806 1/20 0.37
MAP4K4 O95819 1/20 0.37
PRKCG P05129 1/20 0.37
INSR P06213 1/20 0.37
CDK1 P06493 1/20 0.37
FES P07332 1/20 0.37
IGF1R P08069 1/20 0.37
ROS1 P08922 1/20 0.37
FGFR1 P11362 1/20 0.37
PHKG2 P15735 1/20 0.37
FER P16591 1/20 0.37
FLT1 P17948 1/20 0.37

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
SCHEMBL13917369 0.87 HSD17B1 (0.48) METAP2HSD17B1HSD17B2IDO1PLK4
SCHEMBL1925054 0.83 IDO1 (0.53) METAP2HSD17B1HSD17B2IDO1RAB9A
SCHEMBL4905641 0.81 HSD17B1 (0.62) METAP2HSD17B1HSD17B2MAP4K4IRAK4
SCHEMBL27614819 0.81 IDO1 (0.51) METAP2HSD17B1HSD17B2IDO1RAB9A
SCHEMBL1926737 0.81 IDO1 (0.51) METAP2HSD17B1HSD17B2IDO1RAB9A
SCHEMBL2482041 0.80 HSD17B1 (0.47) METAP2HSD17B1HSD17B2IDO1PLK4
SCHEMBL17776911 0.79 CYP3A4 (0.54) METAP2HSD17B1HSD17B2IDO1CHRNB4
SCHEMBL31689000 0.79 KDM1A (0.54) HSD17B1HSD17B2IDO1MAP4K4KDM1A
SCHEMBL15747739 0.79 HPGDS (0.56) HSD17B1HSD17B2IDO1MAP4K4HPGDS
SCHEMBL969090 0.79 MAP4K4 (0.50) METAP2HSD17B1HSD17B2MAP4K4MKNK2

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-109942541-B Fluorenocarbazole derivative and preparation method and application thereof 武汉尚赛光电科技有限公司 2021-06-01 CN disclosed