SCHEMBL28106920

SCHEMBL28106920

CN1CCN(c2ccc(OC(N)=O)cc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.56
NPSR1 Q6W5P4 1/20 0.56
ALDH1A1 P00352 2/20 0.53
KMT2A Q03164 2/20 0.53
MAPT P10636 2/20 0.53
KDM4E B2RXH2 1/20 0.53
ADRA2C P18825 1/20 0.53
GFER P55789 1/20 0.53
PTK2B Q14289 1/20 0.53
ESR2 Q92731 1/20 0.53
NPC1 O15118 4/20 0.51
RAB9A P51151 4/20 0.51
LMNA P02545 1/20 0.50
TP53 P04637 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MEN1 O00255 1/20 0.48
HTR3A P46098 1/20 0.47
CHEK1 O14757 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
SIRT6 Q8N6T7 1/20 0.46

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
SCHEMBL28304654 0.87 L3MBTL1 (0.62) GAAALDH1A1KMT2AMAPTKDM4E
Hydrochloric Acid SCHEMBL10436132 0.85 L3MBTL1 (0.60) GAAALDH1A1KMT2AMAPTKDM4E
SCHEMBL9937342 0.85 GAA (0.57) GAANPSR1ALDH1A1KMT2AMAPT
SCHEMBL28923975 0.85 MAPT (0.55) GAANPSR1ALDH1A1KMT2AMAPT
SCHEMBL8542788 0.84 ALDH1A1 (0.47) GAANPSR1ALDH1A1KMT2AMAPT
SCHEMBL20640028 0.83 MAPT (0.50) GAANPSR1ALDH1A1KMT2AMAPT
SCHEMBL28096400 0.83 ALDH1A1 (0.50) GAANPSR1ALDH1A1KMT2AMAPT
SCHEMBL3914229 0.81 AKR1C3 (0.51) GAAALDH1A1KMT2AMAPTKDM4E
SCHEMBL21590319 0.81 GAA (0.53) GAANPSR1ALDH1A1KMT2AMAPT
SCHEMBL29771394 0.81 GFER (0.51) GAANPSR1ALDH1A1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106103445-B The therapeutical uses of pyrazolo [1,5-A] pyrimidine -5,7- diamine compound and they as CDK inhibitor 癌症研究技术有限公司 2019-08-09 CN disclosed
CN-106103445-A Pyrazolo [1,5 A] pyrimidine 5,7 diamine compound and their therapeutic use as CDK inhibitor 癌症研究技术有限公司 2016-11-09 CN disclosed