SCHEMBL24065254

SCHEMBL24065254

CN(c1nccc(Nc2cc(C3CCCC3)[nH]n2)n1)[C@H]1CC[C@H](NC(=O)Oc2ccccc2)CC1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NEK1 Q96PY6 1/20 0.45
ALDH1A1 P00352 1/20 0.44
RAB9A P51151 1/20 0.44
SRC P12931 1/20 0.43
IGF1R P08069 9/20 0.43
CCNE1 P24864 1/20 0.42
CDK2 P24941 1/20 0.42
PAK4 O96013 2/20 0.42
PAK1 Q13153 2/20 0.42
AURKA O14965 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
SCHEMBL29592850 0.97 NEK1 (0.48) NEK1SRCIGF1RCCNE1CDK2
SCHEMBL24065077 0.97 NEK1 (0.48) NEK1SRCIGF1RCCNE1CDK2
SCHEMBL24065149 0.85 IGF1R (0.44) NEK1SRCIGF1RPAK4PAK1
SCHEMBL24065039 0.85 PAK4 (0.59) NEK1ALDH1A1RAB9ASRCIGF1R
SCHEMBL24065031 0.85 PAK4 (0.59) NEK1ALDH1A1RAB9ASRCIGF1R
SCHEMBL24065151 0.85 SRC (0.50) NEK1SRCIGF1RPAK4PAK1
SCHEMBL25292486 0.84 IGF1R (0.45) NEK1SRCIGF1RCCNE1CDK2
SCHEMBL29594362 0.84 IGF1R (0.45) NEK1SRCIGF1RCCNE1CDK2
SCHEMBL25243495 0.82 IGF1R (0.43) NEK1SRCIGF1RPAK4PAK1
SCHEMBL29592939 0.82 IGF1R (0.43) NEK1SRCIGF1RPAK4PAK1

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-20210369710-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN NALO THERAPEUTICS (US) 2021-12-02 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-20210369710-A1 MODULATORS OF MYC FAMILY PROTO-ONCOGENE PROTEIN MYC, MYCBP, MYCBP2 NEK1 890/4885ALDH1A1 4067/4885RAB9A 1219/4885

“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.