SCHEMBL25826716

SCHEMBL25826716

CC(C)Oc1ccnc2ccc(N3CCOCC3)cc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 1/20 0.51
CDK8 P49336 1/20 0.51
TBK1 Q9UHD2 1/20 0.48
ATR Q13535 11/20 0.47
ATRIP Q8WXE1 3/20 0.44
CLK1 P49759 1/20 0.44
DYRK1A Q13627 1/20 0.44
BMPR1B O00238 1/20 0.43
PDGFRB P09619 1/20 0.43
KIT P10721 1/20 0.43
PDGFRA P16234 1/20 0.43
BMPR1A P36894 1/20 0.43
ACVR1B P36896 1/20 0.43
TGFBR1 P36897 1/20 0.43
ACVRL1 P37023 1/20 0.43
ACVR1 Q04771 1/20 0.43
MAPKAPK2 P49137 1/20 0.43
LRRK2 Q5S007 2/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 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
SCHEMBL25826718 0.88 IP6K1 (0.45) CCNCCDK8TBK1LRRK2MEN1
SCHEMBL25826717 0.88 IP6K1 (0.48) CCNCCDK8LRRK2MEN1KMT2A
SCHEMBL24005893 0.87 CCNC (0.55) CCNCCDK8TGFBR1ACVR1MAPKAPK2
SCHEMBL24010995 0.83 CCNC (0.54) CCNCCDK8BMPR1BPDGFRBKIT
SCHEMBL26317831 0.82 CCNC (0.51) CCNCCDK8BMPR1BPDGFRBKIT
SCHEMBL25826722 0.82 IRAK4 (0.43) CCNCCDK8TBK1ATRACVR1
SCHEMBL25826715 0.81 MAPT (0.52) ATRLRRK2MEN1KMT2AKDM4E
SCHEMBL25821244 0.80 LRRK2 (0.43) LRRK2
SCHEMBL25456835 0.79 CCNC (0.50) CCNCCDK8BMPR1BPDGFRBKIT
SCHEMBL25820105 0.78 CLK1 (0.44) CCNCCDK8CLK1DYRK1ABMPR1B

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
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 US disclosed
US-20230183226-A1 AKT3 MODULATORS Georgiamune Inc. 2023-06-15 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 (1 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-20230183226-A1 AKT3 MODULATORS AKT3, AKT2, MTOR CCNC 821/4885CDK8 567/4885TBK1 824/4885

“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.