SCHEMBL26577408

SCHEMBL26577408

CN1CCC(Nc2nccc(Nc3cc(C4C[C@H]5C[C@@H]4C5)[nH]n3)n2)CC1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PAK4 O96013 3/20 0.55
PAK1 Q13153 3/20 0.55
IGF1R P08069 7/20 0.53
NEK1 Q96PY6 1/20 0.45
CDK4 P11802 2/20 0.43
CCND1 P24385 2/20 0.43
CCND3 P30281 2/20 0.43
CDK6 Q00534 2/20 0.43
CDK1 P06493 1/20 0.43
CCNB1 P14635 1/20 0.43
CCNA2 P20248 1/20 0.43
CDK2 P24941 1/20 0.43
CCNA1 P78396 1/20 0.43
NTRK1 P04629 1/20 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
SCHEMBL26577402 0.86 PAK1 (0.48) PAK4PAK1IGF1RNEK1NTRK1
SCHEMBL25289587 0.86 PAK4 (0.73) PAK4PAK1IGF1RNEK1NTRK1
SCHEMBL30595311 0.86 PAK4 (0.73) PAK4PAK1IGF1RNEK1NTRK1
SCHEMBL26273195 0.84 PAK4 (0.67) PAK4PAK1IGF1RNEK1NTRK1
SCHEMBL26577286 0.77 PAK1 (0.66) PAK4PAK1IGF1RNEK1NTRK1
SCHEMBL28929468 0.77 IGF1R (0.67) PAK4PAK1IGF1RNEK1
SCHEMBL24065116 0.77 IGF1R (0.67) PAK4PAK1IGF1RNEK1
SCHEMBL26577316 0.75 PAK1 (0.72) PAK4PAK1IGF1RNEK1NTRK1
SCHEMBL26577264 0.74 PAK1 (0.67) PAK4PAK1IGF1RNEK1NTRK1
SCHEMBL25293382 0.73 PAK1 (0.65) PAK4PAK1IGF1RNEK1NTRK1

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-20230322722-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN NALO THERAPEUTICS (US) 2023-10-12 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-20230322722-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN MYC, MYCBP, MYCBP2 PAK4 528/4885PAK1 222/4885IGF1R 1878/4885

“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.