SCHEMBL12303348

SCHEMBL12303348

NC(=O)c1cc(Oc2ncccc2C(F)(F)F)c(F)cc1NCc1ccc(F)cc1F

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ P2RY1 P47900 4/20 0.50
▸ CARM1 Q86X55 2/20 0.47
▸ PRMT6 Q96LA8 1/20 0.46
▸ RPS6KB1 P23443 2/20 0.44
▸ AURKA O14965 1/20 0.44
▸ AURKB Q96GD4 1/20 0.44
▸ ROCK2 O75116 2/20 0.44
▸ MAPT P10636 1/20 0.42
▸ CD38 P28907 4/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ KCNH2 Q12809 1/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ MAPK10 P53779 1/20 0.40
▸ CYP3A4 P08684 1/20 0.39
▸ P2RX7 Q99572 1/20 0.39

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
SCHEMBL12303350 0.92 P2RY1 (0.49) P2RY1CARM1PRMT6RPS6KB1AURKA
SCHEMBL12819968 0.88 P2RY1 (0.45) P2RY1CARM1PRMT6RPS6KB1AURKA
SCHEMBL12303836 0.87 KDM4E (0.48) P2RY1CARM1RPS6KB1AURKAAURKB
SCHEMBL12303376 0.77 RPS6KB1 (0.45) P2RY1CARM1PRMT6RPS6KB1AURKA
SCHEMBL13044770 0.72 CFTR (0.53) P2RY1ROCK2MAPTKDM4E
SCHEMBL11922609 0.71 P2RY1 (0.46) P2RY1CARM1PRMT6ROCK2MAPT
SCHEMBL12303356 0.71 KCNH2 (0.67) P2RY1CARM1PRMT6KCNH2CYP2C19
SCHEMBL11991497 0.70 P2RY1 (0.43) P2RY1CARM1PRMT6ROCK2MAPT
SCHEMBL12303615 0.70 KCNH2 (0.51) P2RY1RPS6KB1AURKAROCK2CD38
SCHEMBL12303378 0.70 CYP2C19 (0.43) P2RY1CARM1PRMT6RPS6KB1AURKA

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 P2RY1 1687/4885CARM1 3715/4885PRMT6 1023/4885

“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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