SCHEMBL12303374

SCHEMBL12303374

O=C(O)c1cc(Oc2cccnc2C(F)(F)F)ccc1NCc1ccc(F)cc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP2C19 P33261 2/20 0.45
▸ KDM4E B2RXH2 3/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ P2RY1 P47900 4/20 0.41
▸ KDM4C Q9H3R0 1/20 0.40
▸ PYGL P06737 2/20 0.39
▸ PYGM P11217 2/20 0.39
▸ AURKA O14965 1/20 0.39
▸ RPS6KB1 P23443 1/20 0.39
▸ AURKB Q96GD4 1/20 0.39
▸ MAP2K7 O14733 1/20 0.39
▸ PPARA Q07869 1/20 0.38
▸ MET P08581 1/20 0.38
▸ CD38 P28907 1/20 0.38
▸ MPO P05164 1/20 0.38
▸ PPIA P62937 1/20 0.38
▸ CARM1 Q86X55 1/20 0.38

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
SCHEMBL12303376 0.93 RPS6KB1 (0.45) CYP2C19KDM4EMEN1CYP1A2KMT2A
SCHEMBL12303378 0.91 CYP2C19 (0.43) CYP2C19KDM4EMEN1CYP1A2KMT2A
SCHEMBL12303836 0.79 KDM4E (0.48) CYP2C19KDM4EMEN1CYP1A2KMT2A
SCHEMBL12303859 0.75 KDM4E (0.45) CYP2C19KDM4EMEN1CYP1A2KMT2A
SCHEMBL12303352 0.72 MAOB (0.46) KDM4EMEN1KMT2AAURKARPS6KB1
SCHEMBL17530354 0.71 TDP1 (0.59) CYP2C19MEN1KMT2APYGLPYGM
SCHEMBL12303380 0.70 CYP2C19 (0.81) CYP2C19
SCHEMBL12303348 0.70 P2RY1 (0.50) CYP2C19KDM4EMEN1CYP1A2KMT2A
SCHEMBL12303350 0.69 P2RY1 (0.49) CYP2C19KDM4EMEN1CYP1A2KMT2A
SCHEMBL12819351 0.68 CYP2C19 (0.45) CYP2C19KDM4EMEN1CYP1A2KMT2A

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 CYP2C19 712/4885KDM4E 3158/4885MEN1 4804/4885

“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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