SCHEMBL17041850

SCHEMBL17041850

CC(C)c1ncnc2c1CCN2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NNMT P40261 2/20 0.41
DRD1 P21728 2/20 0.37
AKT1S1 Q96B36 7/20 0.35
MKNK1 Q9BUB5 1/20 0.34
KDR P35968 5/20 0.34
JAK2 O60674 2/20 0.33
CHEK1 O14757 2/20 0.33
DAPK3 O43293 2/20 0.33
PRKD3 O94806 2/20 0.33
MAP4K4 O95819 2/20 0.33
RET P07949 2/20 0.33
FGFR1 P11362 2/20 0.33
FLT1 P17948 2/20 0.33
LTK P29376 2/20 0.33
GRK5 P34947 2/20 0.33
CSNK1A1 P48729 2/20 0.33
CDK8 P49336 2/20 0.33
CDK7 P50613 2/20 0.33
RPS6KA3 P51812 2/20 0.33
LIMK1 P53667 2/20 0.33

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
SCHEMBL17041848 0.89 UHRF1 (0.41) NNMTDRD1AKT1S1KDRCHEK1
SCHEMBL795294 0.75 DRD1 (0.49) NNMTDRD1AKT1S1MKNK1KDR
SCHEMBL30159359 0.75 DRD1 (0.49) NNMTDRD1AKT1S1MKNK1KDR
SCHEMBL21362939 0.71 PRKDC (0.34) KDR
SCHEMBL2606409 0.71 KDR (0.50) NNMTDRD1AKT1S1MKNK1KDR
SCHEMBL3803152 0.71 NNMT (0.44) NNMTDRD1AKT1S1MKNK1KDR
SCHEMBL12832924 0.70 MKNK1 (0.45) NNMTDRD1AKT1S1MKNK1KDR
SCHEMBL2600057 0.70 DRD1 (0.49) NNMTDRD1AKT1S1MKNK1KDR
SCHEMBL16812277 0.70 NNMT (0.41) NNMTDRD1AKT1S1MKNK1KDR
SCHEMBL24773047 0.70 NOTUM (0.39) DRD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230286943-A1 IL-17A MODULATORS SANOFI (FR) 2023-09-14 US disclosed
US-20230227427-A1 IL-17A MODULATORS SANOFI (FR) 2023-07-20 US disclosed
US-20230227427-A1 IL-17A MODULATORS SANOFI (FR) 2023-07-20 US disclosed
US-20180072757-A1 Novel Heterocyclic Derivatives as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2018-03-15 US disclosed
US-9850255-B2 Heterocyclic derivatives as modulators of kinase activity MERCK PATENT GMBH (DE) 2017-12-26 US disclosed
US-9580443-B2 Heterocyclic derivatives as modulators of kinase activity MERCK PATENT GMBH (DE) 2017-02-28 US disclosed
US-9580443-B2 Heterocyclic derivatives as modulators of kinase activity MERCK PATENT GMBH (DE) 2017-02-28 US disclosed
US-20170015679-A1 Novel Heterocyclic Derivatives as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2017-01-19 US disclosed
US-9315517-B2 Imidazol-piperidinyl derivatives as modulators of kinase activity MERCK PATENT GMBH (DE) 2016-04-19 US disclosed
US-20150274750-A1 Novel Heterocyclic Derivatives as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2015-10-01 US disclosed
US-20150239902-A1 Novel Imidazol-piperidinyl Derivatives as Modulators of Kinase Activity MERCK PATENT GMBH (DE) 2015-08-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230227427-A1 IL-17A MODULATORS IL17A, IL2, IL15 NNMT 2352/4885DRD1 4365/4885AKT1S1 4051/4885
US-20170015679-A1 Novel Heterocyclic Derivatives as Modulators of Kinase Activity CDK2, MAP4K3, MAP4K2 NNMT 2367/4885DRD1 3465/4885AKT1S1 372/4885
US-20150274750-A1 Novel Heterocyclic Derivatives as Modulators of Kinase Activity CDK2, MAP4K3, MAP4K2 NNMT 2367/4885DRD1 3465/4885AKT1S1 372/4885
US-20150239902-A1 Novel Imidazol-piperidinyl Derivatives as Modulators of Kinase Activity MAP4K2, MAP4K3, MAP3K4 NNMT 2162/4885DRD1 3782/4885AKT1S1 583/4885
US-20230286943-A1 IL-17A MODULATORS IL17A, IL2, IL15 NNMT 2352/4885DRD1 4365/4885AKT1S1 4051/4885
US-20180072757-A1 Novel Heterocyclic Derivatives as Modulators of Kinase Activity CDK2, MAP4K3, MAP4K2 NNMT 2367/4885DRD1 3465/4885AKT1S1 372/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.