SCHEMBL4143313

SCHEMBL4143313

Cc1cc(-c2nc3cc4c(cc3[nH]2)N(CC(=O)NCc2ccc(F)cc2)C(=O)C4(C)C)n[nH]1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AURKA O14965 2/20 0.59
AURKB Q96GD4 2/20 0.59
ITGB3 P05106 1/20 0.42
ITGAV P06756 1/20 0.42
TP53 P04637 2/20 0.41
CES2 O00748 1/20 0.40
MAPT P10636 1/20 0.38
POLB P06746 1/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL4138011 0.92 AURKA (0.61) AURKAAURKBITGB3ITGAVTP53
SCHEMBL4130802 0.90 AURKA (0.61) AURKAAURKBTP53MAPTLMNA
SCHEMBL4134941 0.86 AURKA (0.58) AURKAAURKBITGB3ITGAV
SCHEMBL4888758 0.85 ITGB3 (0.42) AURKAAURKBITGB3ITGAVALDH1A1
SCHEMBL4130252 0.80 AURKA (0.69) AURKAAURKBTP53MAPTALDH1A1
SCHEMBL4945475 0.79 AURKA (0.92) AURKAAURKB
SCHEMBL5954096 0.78 ITGB3 (0.44) AURKAAURKBITGB3ITGAVKDM4E
SCHEMBL4133178 0.78 AURKA (0.73) AURKAAURKB
SCHEMBL4138252 0.76 AURKA (0.73) AURKAAURKB
SCHEMBL4900368 0.76 TP53 (0.44) AURKAAURKBTP53MAPTLMNA

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-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 US claimed
US-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents F. HOFFMANN-LA ROCHE AG (CH) 2009-06-04 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-20090143375-A1 Tricyclic Lactam Derivatives, Their Manufacture and Use as Pharmaceutical Agents AAAS, CYP3A5, BRCA1 AURKA 2294/4885AURKB 2649/4885ITGB3 3063/4885

“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.