SCHEMBL2714734

SCHEMBL2714734

Cc1cc(CNC(=O)c2cc(C)nc(NC(=O)C3CC3)n2)cc(OC(F)(F)F)c1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.42
ADRB2 P07550 1/20 0.40
JAK1 P23458 1/20 0.39
KDR P35968 1/20 0.38
HTR2C P28335 1/20 0.38
MCHR1 Q99705 3/20 0.36
ABL1 P00519 2/20 0.36
GLS O94925 4/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
MMP13 P45452 1/20 0.35
SCN10A Q9Y5Y9 2/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL2717896 0.89 EPHX2 (0.51) EPHX2ADRB2JAK1HTR2CMCHR1
SCHEMBL2715561 0.88 EPHX2 (0.55) EPHX2JAK1GLSKMT2AMMP13
SCHEMBL2718638 0.87 EPHX2 (0.42) EPHX2ADRB2JAK1KDRHTR2C
SCHEMBL2714413 0.85 ABL1 (0.38) ABL1MMP13
SCHEMBL2717020 0.83 MMP13 (0.41) EPHX2ADRB2KDRKMT2AMMP13
SCHEMBL2715111 0.82 TACR1 (0.49) MCHR1KMT2AMEN1MMP13TSHR
SCHEMBL2714524 0.82 GLS (0.44) KDRGLS
SCHEMBL2715910 0.82 MMP13 (0.46) KDRMMP13
SCHEMBL2713675 0.82 P2RX7 (0.49) EPHX2ADRB2KMT2AMMP13TSHR
SCHEMBL18266292 0.81 EPHX2 (0.47) EPHX2JAK1GLSKMT2AMMP13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP claimed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US claimed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US claimed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 EP claimed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 WO claimed
CN-106478497-B Arylamine derivatives as TTX-S blockers 拉夸里亚创药株式会社 2020-05-08 CN disclosed
EP-2630122-B1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC (JP) 2016-11-30 EP disclosed
US-9302991-B2 Arylamide derivatives as TTX-S blockers RAQUALIA PHARMA INC. (JP) 2016-04-05 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
US-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2014-11-13 US disclosed
EP-2630122-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RaQualia Pharma Inc (JP) 2013-08-28 EP disclosed
WO-2012053186-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS RAQUALIA PHARMA INC. (JP) 2012-04-26 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-20140336377-A1 ARYLAMIDE DERIVATIVES AS TTX-S BLOCKERS SCN2B, SCN1B, SCN2A EPHX2 2460/4885ADRB2 348/4885JAK1 4790/4885

“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.