SCHEMBL12303705

SCHEMBL12303705

COC(=O)c1cc(Oc2ncccc2C(F)(F)F)ccc1Nc1ccccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MAPK10 P53779 5/20 0.45
▸ MAPK8 P45983 3/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ P2RY1 P47900 5/20 0.43

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
SCHEMBL12303747 0.89 TDP1 (0.54) MAPK10MAPK8TDP1P2RY1
SCHEMBL12819938 0.88 P2RY1 (0.46) MAPK10MAPK8TDP1P2RY1
SCHEMBL12303715 0.87 P2RY1 (0.43) MAPK10MAPK8TDP1P2RY1
SCHEMBL12303718 0.83 TRPV1 (0.44) TDP1P2RY1
SCHEMBL12763926 0.82 TDP1 (0.44) TDP1P2RY1
SCHEMBL11922572 0.82 FPR2 (0.48) TDP1P2RY1
SCHEMBL12303727 0.81 P2RY1 (0.49) MAPK10MAPK8P2RY1
SCHEMBL11991467 0.80 SCN9A (0.44) TDP1P2RY1
SCHEMBL12303690 0.79 TDP1 (0.49) TDP1P2RY1
SCHEMBL11922573 0.79 CFTR (0.51) TDP1P2RY1

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 MAPK10 3660/4885MAPK8 4032/4885TDP1 1792/4885

“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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