SCHEMBL12303703

SCHEMBL12303703

NC(=O)c1cc(Oc2ncccc2C(F)(F)F)ccc1I

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 2/20 0.48
▸ FPR2 P25090 1/20 0.48
▸ RAB9A P51151 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ DRD1 P21728 3/20 0.44
▸ KCNH2 Q12809 1/20 0.42
▸ MGLL Q99685 1/20 0.40
▸ MAPK10 P53779 1/20 0.40

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
SCHEMBL12303610 0.87 SCN9A (0.48) SCN9AFPR2RAB9AALDH1A1MAPT
SCHEMBL12303690 0.86 TDP1 (0.49) SCN9AFPR2ALDH1A1MAPTATM
SCHEMBL12303601 0.82 FPR2 (0.45) SCN9AFPR2RAB9AALDH1A1MAPT
SCHEMBL11922573 0.77 CFTR (0.51) SCN9AFPR2ALDH1A1MAPTATM
SCHEMBL12303615 0.76 KCNH2 (0.51) SCN9AFPR2RAB9ADRD1KCNH2
SCHEMBL12303836 0.75 KDM4E (0.48) SCN9AFPR2KCNH2MAPK10
SCHEMBL4318313 0.73 ALDH1A1 (0.54) SCN9AFPR2ALDH1A1MAPTATM
SCHEMBL30678410 0.73 RAB9A (0.70) RAB9AALDH1A1DRD1
SCHEMBL12303339 0.73 HDAC3 (0.46) MAPK10
SCHEMBL11187255 0.72 ALDH1A1 (0.59) SCN9AFPR2ALDH1A1MAPTATM

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 SCN9A 2265/4885FPR2 2994/4885RAB9A 1527/4885

“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.

Send feedback