SCHEMBL12303357

SCHEMBL12303357

COC(=O)c1cc(O)c(F)cc1NCc1ccc(F)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 1/20 0.41
▸ RPS6KB1 P23443 1/20 0.41
▸ AURKB Q96GD4 1/20 0.41
▸ EGFR P00533 4/20 0.41
▸ NOX4 Q9NPH5 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.40
▸ GAA P10253 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ AGER Q15109 1/20 0.39
▸ MAPK8 P45983 1/20 0.39
▸ PDE10A Q9Y233 1/20 0.39
▸ LMNA P02545 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ VNN1 O95497 1/20 0.38
▸ MAOB P27338 2/20 0.38
▸ KCNK3 O14649 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
SCHEMBL11991452 0.75 PTGER4 (0.41) KDM4EGAAAGERLMNAMAPT
SCHEMBL15515721 0.74 EGFR (0.48) EGFRNOX4KDM4EGAAMEN1
SCHEMBL12303350 0.74 P2RY1 (0.49) AURKARPS6KB1AURKBKDM4EMEN1
SCHEMBL20236380 0.72 MAPT (0.45) KDM4EMEN1KMT2ALMNANPC1
SCHEMBL29109570 0.71 MAPT (0.47) AURKARPS6KB1AURKBGAAMEN1
SCHEMBL25342477 0.71 CA12 (0.50) KDM4EGAALMNANPC1MAPT
SCHEMBL31024702 0.71 CA12 (0.50) KDM4EGAALMNANPC1MAPT
SCHEMBL12303349 0.70 AURKA (0.51) AURKARPS6KB1AURKBKDM4EMAPK8
SCHEMBL12303352 0.70 MAOB (0.46) AURKARPS6KB1AURKBEGFRNOX4
SCHEMBL11922561 0.70 CA12 (0.40) KDM4EGAAAGERLMNASMN1; SMN2

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-20110230465-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGLEHEIM INTERNATIONAL GMBH (DE) 2011-09-22 — — US disclosed
US-20110230465-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGLEHEIM INTERNATIONAL GMBH (DE) 2011-09-22 — — 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-20110230465-A1 VIRAL POLYMERASE INHIBITORS POLR2A, POLR2H, POLR2E AURKA 3079/4885RPS6KB1 405/4885AURKB 1951/4885

“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.

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