SCHEMBL28809240

SCHEMBL28809240

Cc1c(Br)ccc2c1c(C(=O)O)nn2C

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.33
HCAR3 P49019 1/20 0.33
MCL1 Q07820 1/20 0.33
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPK8 P45983 1/20 0.32
EPRS1 P07814 1/20 0.32
APOBEC3A P31941 1/20 0.32
CTDSP1 Q9GZU7 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
GPR35 Q9HC97 1/20 0.32
RAB9A P51151 3/20 0.32
POLB P06746 1/20 0.32
MAPK1 P28482 2/20 0.31
MAPT P10636 2/20 0.31
NPC1 O15118 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
ALDH1A1 P00352 2/20 0.31
NPSR1 Q6W5P4 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31

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
SCHEMBL31123882 1.00 KDM4E (0.33) KDM4EHCAR3MCL1MEN1KMT2A
SCHEMBL31729301 1.00 KDM4E (0.33) KDM4EHCAR3MCL1MEN1KMT2A
SCHEMBL31728984 0.84 ELANE (0.39) KDM4EMEN1KMT2APOLBMAPT
SCHEMBL23563020 0.83 KDM4E (0.33) KDM4EHCAR3MCL1MEN1KMT2A
SCHEMBL31704421 0.83 KDM4E (0.33) KDM4EHCAR3MCL1MEN1KMT2A
SCHEMBL29753942 0.82 MEN1 (0.44) KDM4EMCL1MEN1KMT2AMAPK8
SCHEMBL23563223 0.79 KDM4E (0.39) KDM4EMEN1KMT2ARAB9AMAPT
SCHEMBL8320853 0.74 NAMPT (0.40) KDM4EMEN1KMT2AMAPK1MAPT
SCHEMBL30910209 0.73
SCHEMBL16493936 0.72 RXFP1 (0.37) KDM4EMCL1MAPK8APOBEC3ACTDSP1

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-114867718-A Novel indazole derivative and use thereof 韩国化学研究院 2022-08-05 CN disclosed