SCHEMBL25467673

SCHEMBL25467673

Cc1c(C(C)C)nn2c(C(C)C)cc(C(C)C)nc12

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.36
HPGD P15428 3/20 0.36
HSD17B10 Q99714 3/20 0.36
MAPT P10636 3/20 0.36
MAPK1 P28482 2/20 0.36
ALDH1A1 P00352 1/20 0.36
NOS3 P29474 1/20 0.33
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
TSHR P16473 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 3/20 0.32
PDE2A O00408 1/20 0.31
HSP90AA1 P07900 1/20 0.31

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
SCHEMBL16202093 0.85 KDM4E (0.42) KDM4EHPGDHSD17B10MAPTMAPK1
SCHEMBL25465766 0.83 KDM4E (0.33) KDM4EHPGDHSD17B10MAPTMAPK1
SCHEMBL24470101 0.69 PDE2A (0.38) ALDH1A1NOS3NOS1NOS2PDE2A
SCHEMBL25540306 0.66
SCHEMBL27122276 0.66 CCNT1 (0.54)
SCHEMBL25315788 0.64 HPGD (0.39) KDM4EHPGDHSD17B10MAPTMAPK1
SCHEMBL2737328 0.61 ALDH1A1 (0.35) ALDH1A1NOS3NOS1NOS2
SCHEMBL23547478 0.61 CCNT1 (0.34)
SCHEMBL27112088 0.61
SCHEMBL27112078 0.61 KDM4E (0.36) KDM4EMAPK1

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-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-05-16 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-11649238-B2 Substituted pyrazolo[1,5-a]pyrimidines as PI4K inhibitors PI4K2A, PI4K2B, PI4KA KDM4E 577/4885HPGD 4357/4885HSD17B10 4239/4885

“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.