SCHEMBL25847223

SCHEMBL25847223

CSn1cc(-c2cncc(C(C)C)c2)nn1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ESRRG P62508 1/20 0.32
PIM1 P11309 2/20 0.32
PIM3 Q86V86 2/20 0.32
PIM2 Q9P1W9 2/20 0.32
BRAF P15056 1/20 0.31
PRMT5 O14744 1/20 0.30
WDR77 Q9BQA1 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
SCHEMBL25832827 0.79 CYP19A1 (0.39) ESRRG
SCHEMBL25820285 0.79 CYP19A1 (0.37) ESRRGPIM1PIM3PIM2BRAF
SCHEMBL19756414 0.68 PPARA (0.39) PRMT5WDR77
SCHEMBL19756413 0.67 SMN1; SMN2 (0.50) PRMT5WDR77
SCHEMBL21282892 0.66 MKNK1 (0.50) PIM1PIM3PIM2PRMT5WDR77
SCHEMBL13086421 0.65 CYP2D6 (0.38) PIM1PIM3PIM2PRMT5WDR77
SCHEMBL19756421 0.64 PRMT5 (0.40) PRMT5WDR77
SCHEMBL725480 0.64 PRMT5 (0.34) PRMT5WDR77
SCHEMBL13086621 0.64 MKNK1 (0.49) PRMT5WDR77
SCHEMBL13086628 0.63 CYP2A6 (0.51) PIM1PIM3PIM2

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-20230219927-A1 AKT3 MODULATORS Georgiamune Inc. 2023-07-13 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-20230219927-A1 AKT3 MODULATORS AKT3, AKT2, PIK3CA ESRRG 604/4885PIM1 1187/4885PIM3 322/4885

“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.