SCHEMBL28292829

SCHEMBL28292829

ClC(Cl)N1CCc2ccccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
USP2 O75604 1/20 0.48
CDK4 P11802 1/20 0.48
ALOX15 P16050 1/20 0.48
CCND1 P24385 1/20 0.48
SIGMAR1 Q99720 1/20 0.46
SLC6A2 P23975 2/20 0.44
SLC6A4 P31645 2/20 0.44
NOTUM Q6P988 1/20 0.43
GAA P10253 4/20 0.42
TP53 P04637 3/20 0.42
MAPT P10636 2/20 0.42
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
DRD2 P14416 1/20 0.42
DRD1 P21728 1/20 0.42
DRD4 P21917 1/20 0.42
DRD5 P21918 1/20 0.42

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
SCHEMBL14060360 0.84 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL19953534 0.80 MEN1 (0.42) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL1102007 0.79 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL14110030 0.79 ALDH1A1 (0.48) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL13066479 0.76 ALDH1A1 (0.50) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL5848569 0.76 SLC6A2 (0.52) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL25112007 0.76 SLC6A2 (0.49) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL16600454 0.76 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL21859763 0.76 SLC6A2 (0.52) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL21085252 0.76 ALDH1A1 (0.46) ALDH1A1MEN1KMT2AUSP2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111995561-B High-yield preparation method of polychloro-methylindoline without metal catalyst 哈尔滨商业大学 2023-07-04 CN disclosed
CN-111995561-A High-yield preparation method of polychlorinated methyl indoline without metal catalyst 哈尔滨商业大学 2020-11-27 CN disclosed
CN-109776378-B Preparation method of polychlorinated methyl indoline without metal catalyst 哈尔滨商业大学 2020-10-09 CN disclosed
CN-109776378-A Preparation method of polychlorinated methyl indoline without metal catalyst 哈尔滨商业大学 2019-05-21 CN disclosed