SCHEMBL29643237

SCHEMBL29643237

Cn1c2ccccc2c2cc(C(N)=O)ccc21

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.76
NPC1 O15118 4/20 0.59
ALDH1A1 P00352 5/20 0.56
HSD17B10 Q99714 2/20 0.56
BRD4 O60885 1/20 0.56
BRPF1 P55201 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
GPR3 P46089 1/20 0.55
POLB P06746 2/20 0.54
HPGD P15428 4/20 0.54
MAPT P10636 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
HTT P42858 1/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
EGFR P00533 1/20 0.51
SRC P12931 1/20 0.51
NPY5R Q15761 1/20 0.51
RORC P51449 1/20 0.51
RAB9A P51151 2/20 0.50

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
SCHEMBL21775981 0.93 KDM4E (0.64) KDM4ENPC1ALDH1A1HSD17B10BRD4
SCHEMBL28039676 0.90 KDM4E (0.62) KDM4ENPC1ALDH1A1HSD17B10BRD4
SCHEMBL30850787 0.86 KDM4E (1.00) KDM4ENPC1ALDH1A1HSD17B10GPR3
SCHEMBL2026269 0.86 KDM4E (0.76) KDM4ENPC1ALDH1A1HSD17B10GPR3
SCHEMBL3102894 0.86 KDM4E (1.00) KDM4ENPC1ALDH1A1HSD17B10GPR3
SCHEMBL23863969 0.85 KDM4E (0.64) KDM4ENPC1ALDH1A1HSD17B10GPR3
SCHEMBL29643244 0.83 NPC1 (0.80) KDM4ENPC1ALDH1A1HPGDMAPT
SCHEMBL28266234 0.83 NPC1 (0.80) KDM4ENPC1ALDH1A1HPGDMAPT
SCHEMBL4687866 0.82 KDM4E (0.69) KDM4ENPC1ALDH1A1HSD17B10GPR3
SCHEMBL9760859 0.82 KDM4E (0.69) KDM4ENPC1ALDH1A1HSD17B10GPR3

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-109206360-B Carbazole amide derivative or salt thereof, and preparation method and application thereof 复旦大学 2022-05-17 CN disclosed