SCHEMBL3384698

SCHEMBL3384698

NCCCNc1nc(Nc2ccc3nc[nH]c3c2)ncc1C1CC1

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CDK1 P06493 8/20 0.55
SYK P43405 1/20 0.52
ULK1 O75385 1/20 0.52
ULK2 Q8IYT8 1/20 0.52
STK17A Q9UEE5 10/20 0.48
STK17B O94768 6/20 0.48

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
SCHEMBL3384686 0.86 SYK (0.59) CDK1SYKULK1ULK2
SCHEMBL3387331 0.84 STK17A (0.52) SYKULK1STK17ASTK17B
SCHEMBL3388268 0.83 SYK (0.52) SYKSTK17ASTK17B
SCHEMBL13431846 0.83 TBK1 (0.69) ULK1ULK2STK17A
SCHEMBL3389585 0.83 STK17A (0.48) ULK1ULK2STK17ASTK17B
SCHEMBL3386164 0.82 STK17A (0.60) STK17ASTK17B
SCHEMBL3387317 0.82 SYK (0.52) SYKULK1STK17ASTK17B
SCHEMBL3386224 0.81 STK17A (0.48) STK17ASTK17B
SCHEMBL3386112 0.80 TBK1 (0.56) SYKULK1ULK2STK17ASTK17B
SCHEMBL3385958 0.79 STK17A (0.68) STK17ASTK17B

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056524-A1 Compound MEDICAL RESEARCH COUNCIL TECHNOLOGY (GB) 2010-03-04 US disclosed
WO-2009122180-A1 PYRIMIDINE DERIVATIVES CAPABLE OF INHIBITING ONE OR MORE KINASES MEDICAL RESEARCH COUNCIL (GB) 2009-10-08 WO 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-20100056524-A1 Compound NR3C2, NR3C1, NR2E3 CDK1 529/4885SYK 627/4885ULK1 2369/4885

“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.