SCHEMBL11922602

SCHEMBL11922602

CC(C)N(C(=O)c1ccc(Cl)cn1)c1cc(F)c(Oc2ncc(Cn3nccn3)cc2C(F)(F)F)cc1C(=O)O

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 3/20 0.32
▸ EIF4EBP1 Q13541 8/20 0.32
▸ TRPM8 Q7Z2W7 1/20 0.32
▸ LTC4S Q16873 2/20 0.31
▸ GPBAR1 Q8TDU6 2/20 0.31
▸ MRGPRX4 Q96LA9 1/20 0.30
▸ P2RX3 P56373 1/20 0.30

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
SCHEMBL11922596 0.93 SCN9A (0.33) SCN9AGPBAR1MRGPRX4P2RX3
SCHEMBL11991482 0.93 SCN9A (0.32) SCN9AEIF4EBP1LTC4SGPBAR1
SCHEMBL11922631 0.91 GRM2 (0.30) —
SCHEMBL11922615 0.88 SCN9A (0.34) SCN9ATRPM8LTC4SMRGPRX4
SCHEMBL13044776 0.86 HDAC8 (0.33) SCN9ATRPM8GPBAR1
SCHEMBL13044759 0.85 HDAC8 (0.34) SCN9ATRPM8GPBAR1
SCHEMBL13044775 0.85 GAA (0.34) SCN9ALTC4SGPBAR1MRGPRX4
SCHEMBL11991501 0.85 EIF4EBP1 (0.32) EIF4EBP1LTC4S
SCHEMBL13044761 0.85 PTGER1 (0.32) SCN9A
SCHEMBL11992939 0.84 MET (0.30) —

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242140-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-08-14 — — US disclosed
US-8242140-B2 Viral polymerase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-08-14 — — US disclosed
US-20100190779-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-07-29 — — US disclosed
US-20100190779-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-07-29 — — US disclosed
WO-2009018657-A1 VIRAL POLYMERASE INHIBITORS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-02-12 — — 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-20100190779-A1 VIRAL POLYMERASE INHIBITORS POLR2A, POLR2H, POLR2E SCN9A 2265/4885EIF4EBP1 1549/4885TRPM8 4832/4885

“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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