SCHEMBL11026178

SCHEMBL11026178

Cc1ccc(C2CC(C)(C)c3cc(F)cc(C(=O)NS(C)(=O)=O)c3N2)cc1N1CCCC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 1/20 0.34
▸ SCN9A Q15858 9/20 0.33
▸ MYC P01106 2/20 0.33
▸ PRNP P04156 1/20 0.33
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ CFTR P13569 1/20 0.32
▸ AR P10275 3/20 0.31
▸ SCN2B O60939 1/20 0.31
▸ SCN1B Q07699 1/20 0.31
▸ SCN5A Q14524 1/20 0.31
▸ ATM Q13315 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
SCHEMBL11022437 0.90 SCN9A (0.35) SCN9AMYCLMNAMAPT
SCHEMBL11029114 0.86 MAPT (0.36) LMNAMAPTAR
SCHEMBL11027013 0.86 SCN9A (0.35) SCN9AMAPTCFTRSCN2BSCN1B
SCHEMBL11026405 0.84 SCN9A (0.35) SCN9AMYCLMNAMAPTAR
SCHEMBL11027159 0.81 MEN1 (0.37) SCN9ALMNAMAPTSCN2BSCN1B
SCHEMBL11029154 0.80 SCN2B (0.35) SCN9ALMNAMAPTSCN2BSCN1B
SCHEMBL11026324 0.79 CYP2C19 (0.38) SCN9AMAPTCFTRSCN2BSCN1B
SCHEMBL11940912 0.77 SCN9A (0.38) SCN9AMAPTSCN2BSCN1BSCN5A
SCHEMBL11940905 0.76 SCN9A (0.38) HTR7SCN9ALMNAMAPTAR
SCHEMBL11025220 0.76 ADRB1 (0.34) SCN9ALMNAMAPTSCN2BSCN1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8809369-B2 Tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2014-08-19 — — US claimed
EP-2668165-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2013-12-04 — — EP claimed
WO-2012101068-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-08-02 — — WO claimed
US-20120190677-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — US claimed
US-8809369-B2 Tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2014-08-19 — — US disclosed
EP-2668165-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2013-12-04 — — EP disclosed
WO-2012101068-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-08-02 — — WO disclosed
US-20120190677-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — 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-20120190677-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES RAB1A, RABL3, RAB7A HTR7 826/4885SCN9A 1420/4885MYC 4006/4885

“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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