SCHEMBL28528207

SCHEMBL28528207

N#Cc1ccccc1CC1=c2ccccc2=NC1=O

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.36
ALDH1A1 P00352 5/20 0.34
CTSB P07858 1/20 0.33
KMT2A Q03164 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
CREBBP Q92793 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NOX4 Q9NPH5 1/20 0.33
MAPT P10636 1/20 0.33
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
SLC6A4 P31645 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL28675257 0.74 MAPT (0.35) ALDH1A1KMT2ANPSR1MAPT
SCHEMBL28170701 0.73 CALM1 (0.39) ALDH1A1KMT2ANPSR1MAPTKDM4E
SCHEMBL2153612 0.71 CYP19A1 (0.48) CYP19A1ALDH1A1NPSR1SMN1; SMN2MAPT
SCHEMBL8023202 0.71 CYP19A1 (0.36) CYP19A1ALDH1A1CTSBKMT2ACREBBP
SCHEMBL29012480 0.69 MAPT (0.39) ALDH1A1KMT2ANPSR1SMN1; SMN2MAPT
SCHEMBL9260372 0.69 CYP11B1 (0.40) CYP19A1ALDH1A1KMT2ANPSR1MAPT
SCHEMBL28924285 0.69 ALDH1A1 (0.31) ALDH1A1KMT2ANPSR1MAPT
SCHEMBL3520478 0.69 ATM (0.38) ALDH1A1KMT2ANPSR1SMN1; SMN2MAPT
SCHEMBL6660995 0.69 MAPT (0.37) ALDH1A1KMT2ANPSR1SMN1; SMN2MAPT
SCHEMBL9159521 0.69 MAPT (0.37) ALDH1A1KMT2ANPSR1SMN1; SMN2MAPT

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112358434-B Preparation method of 3- (o-cyanobenzyl) indol-2-one compound 湖南理工学院 2025-04-22 CN claimed
CN-112358434-A Preparation method of 3- (o-cyanobenzyl) indole-2-ketone compound 湖南理工学院 2021-02-12 CN claimed
CN-112358434-B Preparation method of 3- (o-cyanobenzyl) indol-2-one compound 湖南理工学院 2025-04-22 CN disclosed
CN-112358434-B Preparation method of 3- (o-cyanobenzyl) indol-2-one compound 湖南理工学院 2025-04-22 CN disclosed
CN-112358434-A Preparation method of 3- (o-cyanobenzyl) indole-2-ketone compound 湖南理工学院 2021-02-12 CN disclosed