SCHEMBL12303337

SCHEMBL12303337

Cc1ccc(CNc2ccc(Oc3ncc(I)cc3C(F)(F)F)cc2C(N)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 1/20 0.45
▸ MAPK10 P53779 8/20 0.40
▸ RPS6KB1 P23443 6/20 0.40
▸ AURKA O14965 5/20 0.40
▸ VNN1 O95497 1/20 0.39
▸ MAPK8 P45983 4/20 0.38
▸ AURKB Q96GD4 1/20 0.37
▸ PTGER4 P35408 1/20 0.37
▸ KCNH2 Q12809 1/20 0.37
▸ CD38 P28907 1/20 0.36

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
SCHEMBL12303615 0.85 KCNH2 (0.51) RAB9ARPS6KB1AURKAKCNH2CD38
SCHEMBL12303339 0.78 HDAC3 (0.46) MAPK10MAPK8
SCHEMBL11991519 0.72 KMT2A (0.35) MAPK10MAPK8PTGER4
SCHEMBL11991535 0.72 KMT2A (0.35) MAPK10MAPK8
SCHEMBL11992594 0.71 KMT2A (0.35) MAPK10MAPK8
SCHEMBL12303335 0.69 KCNH2 (0.74) KCNH2
SCHEMBL11922579 0.69 TDP1 (0.48) KCNH2
SCHEMBL12303834 0.69 KCNH2 (0.54) KCNH2
SCHEMBL12303836 0.67 KDM4E (0.48) MAPK10RPS6KB1AURKAMAPK8AURKB
SCHEMBL12946090 0.67 DRD1 (0.34) —

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 3 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
WO-2011032277-A1 QUINAZOLINONE DERIVATIVES AS VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-03-24 — — WO 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 RAB9A 1527/4885MAPK10 3660/4885RPS6KB1 405/4885

“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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