SCHEMBL24916018

SCHEMBL24916018

CCc1cnc2cncc(C(C)C)c2c1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.31
GPR55 Q9Y2T6 1/20 0.30
NR3C2 P08235 1/20 0.30
PDE4A P27815 1/20 0.30
PDE4B Q07343 1/20 0.30
PDE4C Q08493 1/20 0.30
PDE4D Q08499 1/20 0.30

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
SCHEMBL24915595 0.79 PSMB5 (0.33) NR3C2
SCHEMBL21008176 0.79 NR3C2 (0.40) PDE10ANR3C2
SCHEMBL24915897 0.77 CYP1A2 (0.36)
SCHEMBL29923857 0.76 MAPT (0.34) PDE4APDE4BPDE4CPDE4D
SCHEMBL24916128 0.76 MAPT (0.34) PDE4APDE4BPDE4CPDE4D
SCHEMBL21569496 0.73 CYP1A2 (0.43) PDE10A
SCHEMBL24916019 0.73 CYP1A1 (0.34)
SCHEMBL24916546 0.72 RPS6KA3 (0.31)
SCHEMBL24930878 0.69 DHFR (0.33)
SCHEMBL15417377 0.69 DHFR (0.33)

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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2023-01-26 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-20230026466-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 PDE10A 3835/4885GPR55 1904/4885NR3C2 2668/4885

“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.