SCHEMBL2372098

SCHEMBL2372098

CCOc1cc2nc(-c3cccc(C(F)(F)F)c3)c(CBr)c(C(=O)OC)c2cc1S(C)(=O)=O

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 11/20 0.40
NR1I2 O75469 1/20 0.40
NAMPT P43490 1/20 0.38
PTGFR P43088 4/20 0.37
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
PLK1 P53350 1/20 0.36
KDM4E B2RXH2 1/20 0.36
TACR2 P21452 1/20 0.35
TACR3 P29371 1/20 0.35
KCNH2 Q12809 1/20 0.35
CACNA1C Q13936 1/20 0.35
SCN5A Q14524 1/20 0.35
SDHB P21912 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
SCHEMBL2372623 0.93 TRPV4 (0.38) TRPV4NR1I2NAMPTPTGFRMEN1
SCHEMBL2373257 0.91 TRPV4 (0.39) TRPV4NR1I2NAMPTPTGFRMEN1
SCHEMBL2373280 0.90 DHODH (0.44) TRPV4NR1I2NAMPTPTGFRMEN1
SCHEMBL2465453 0.89 TRPV4 (0.38) TRPV4NR1I2PTGFRTACR2TACR3
SCHEMBL2372631 0.87 TRPV4 (0.39) TRPV4PTGFRMAPTKDM4ETACR2
SCHEMBL2372846 0.87 CTSA (0.41) TRPV4NR1I2NAMPTPTGFRMEN1
SCHEMBL2461674 0.87 PTGFR (0.40) TRPV4PTGFRPLK1
SCHEMBL2372311 0.85 TRPV4 (0.40) TRPV4NR1I2NAMPTPTGFRMEN1
SCHEMBL2372484 0.84 CTSA (0.38) TRPV4PTGFRTACR2TACR3KCNH2
SCHEMBL2372897 0.83 DHODH (0.44) NAMPTPTGFRMEN1MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2549872-B1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2015-11-25 EP disclosed
US-8658636-B2 TRPV4 antagonists GlaxoSmithKline, LLC (US) 2014-02-25 US disclosed
EP-2549872-A1 TRPV4 ANTAGONISTS GlaxoSmithKline LLC (US) 2013-01-30 EP disclosed
US-20130012499-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2013-01-10 US disclosed
WO-2011119704-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 WO disclosed
WO-2011119701-A1 TRPV4 ANTAGONISTS GLAXOSMITHKLINE LLC (US) 2011-09-29 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-20130012499-A1 TRPV4 ANTAGONISTS TRPV4, TRPV2, TRPV5 TRPV4 1/4885NR1I2 724/4885NAMPT 794/4885

“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.