SCHEMBL28812751

SCHEMBL28812751

Cc1ccc(-n2ccnc2-c2c[c]ccc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.40
MAPK9 P45984 1/20 0.40
MAPK10 P53779 1/20 0.40
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MAPKAPK2 P49137 2/20 0.35
POLB P06746 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
PKM P14618 1/20 0.34
RAB9A P51151 1/20 0.34
FLT1 P17948 2/20 0.34
FLT4 P35916 2/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP2E1 P05181 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2A6 P11509 1/20 0.33
P2RX4 Q99571 1/20 0.33

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
SCHEMBL27968890 0.85 KDR (0.40) KDRMAPK9MAPK10ALDH1A1POLB
SCHEMBL27969018 0.81 MAPK9 (0.43) KDRMAPK9MAPK10ALDH1A1SMN1; SMN2
SCHEMBL26562756 0.81 KDR (0.55) KDRMAPK9MAPK10ALDH1A1SMN1; SMN2
SCHEMBL27969021 0.78 KDR (0.40) KDRMAPK9MAPK10ALDH1A1MAPKAPK2
SCHEMBL2874163 0.76 HDAC4 (0.40) KDM4ENPC1PKMRAB9AKMT2A
SCHEMBL13309568 0.74 MAPK9 (0.60) KDRMAPK9MAPK10ALDH1A1SMN1; SMN2
SCHEMBL11091622 0.74 KDR (0.51) KDRMAPK9MAPK10ALDH1A1SMN1; SMN2
SCHEMBL15987568 0.73 MAPK9 (0.48) KDRMAPK9MAPK10FLT1FLT4
SCHEMBL28354286 0.72 NPC1 (0.45) KDRMAPK9MAPK10ALDH1A1SMN1; SMN2
SCHEMBL1052342 0.72 EGFR (0.45) KDRMAPK9MAPK10ALDH1A1SMN1; SMN2

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-104011022-A 4-aminocarbazole compound and use of same TOSOH CORP 2014-08-27 CN disclosed