SCHEMBL5818756

SCHEMBL5818756

CC(C)C(=O)Nc1cccc(-c2ccnc3c(C(=O)c4cccs4)cnn23)c1

nearest known ligand 0.74

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CDKN1A P38936 1/20 0.74
MAPK13 O15264 1/20 0.49
PIM1 P11309 1/20 0.49
BRAF P15056 13/20 0.49
EPHA2 P29317 1/20 0.47
GSK3A P49840 1/20 0.47
TLR8 Q9NR97 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47

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
SCHEMBL5811152 0.93 CDKN1A (0.72) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL6071432 0.91 CDKN1A (0.70) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL5823543 0.91 CDKN1A (0.71) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL5823349 0.90 CDKN1A (0.68) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL5613426 0.90 CDKN1A (0.77) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL5946404 0.90 CDKN1A (0.70) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL5821478 0.90 CDKN1A (0.72) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL4497345 0.89 CDKN1A (0.79) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL5808894 0.89 CDKN1A (0.79) CDKN1AMAPK13PIM1BRAFEPHA2
SCHEMBL5816166 0.89 CDKN1A (0.71) CDKN1AMAPK13PIM1BRAFEPHA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006033795-A2 SUBSTITUTED PYRAZOLO [1, 5-A] PYRIMIDINES FOR INHIBITING ABNORMAL CELL GROWTH WYETH (US) 2006-03-30 WO claimed
WO-2006033795-A2 SUBSTITUTED PYRAZOLO [1, 5-A] PYRIMIDINES FOR INHIBITING ABNORMAL CELL GROWTH WYETH (US) 2006-03-30 WO disclosed
US-20060063784-A1 Method of using substituted pyrazolo [1,5-a] pyrimidines WYETH 2006-03-23 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-20060063784-A1 Method of using substituted pyrazolo [1,5-a] pyrimidines TYMP, DPYD, TYMS CDKN1A 89/4885MAPK13 1727/4885PIM1 797/4885

“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.