SCHEMBL29311529

SCHEMBL29311529

CCC(C)n1ncc2cccnc21

nearest known ligand 0.45

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.45
PDE1A P54750 13/20 0.40
PDE1B Q01064 13/20 0.40
PDE1C Q14123 12/20 0.40
KDM4D Q6B0I6 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CCND2 P30279 1/20 0.35
CCND3 P30281 1/20 0.35
FGFR1 P11362 1/20 0.34
FGFR4 P22455 1/20 0.34
RET P07949 1/20 0.34

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
SCHEMBL29311444 0.84 KDM4E (0.40) KDM4EPDE1APDE1BPDE1CKDM4D
SCHEMBL14016377 0.83 KDM4E (0.50) KDM4EPDE1APDE1BPDE1CKDM4D
SCHEMBL25612718 0.77 ADORA3 (0.40) KDM4EPDE1APDE1BPDE1CKDM4D
SCHEMBL21311189 0.76 KDM4E (0.44) KDM4EPDE1APDE1BPDE1CKDM4D
SCHEMBL24983893 0.75 KDM4E (0.43) KDM4EPDE1APDE1BPDE1CKDM4D
SCHEMBL3862440 0.75 RECQL (0.42) KDM4EL3MBTL1
SCHEMBL31469698 0.74 KMO (0.39) L3MBTL1CDK4CCND1CCND2CCND3
SCHEMBL15970721 0.73 HDAC8 (0.46)
SCHEMBL983824 0.73 KDM4E (0.50) KDM4EPDE1APDE1BPDE1CKDM4D
SCHEMBL18926932 0.72 KDM4E (0.46) KDM4EKDM4DFGFR1FGFR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240228469-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2024-07-11 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-20240228469-A1 PCSK9 INHIBITORS AND METHODS OF USE THEREOF PCSK9, PCSK7, PCSK6 KDM4E 3520/4885PDE1A 2898/4885PDE1B 2619/4885

“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.