SCHEMBL2373480

SCHEMBL2373480

CSc1ccc2c(C(=O)O)c(C)c(-c3cccc(C(F)(F)F)c3)nc2c1

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 12/20 0.60
TSHR P16473 1/20 0.50
PDE10A Q9Y233 1/20 0.50
PTGFR P43088 4/20 0.44
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
XDH P47989 1/20 0.43
PIN1 Q13526 1/20 0.43

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
SCHEMBL2464727 0.93 DHODH (0.71) DHODHTSHRPDE10APTGFR
SCHEMBL2372696 0.89 DHODH (0.48) DHODHPTGFRALDH1A1SMN1; SMN2
SCHEMBL2372855 0.86 DHODH (0.71) DHODHTSHRPDE10APTGFR
SCHEMBL2373037 0.85 DHODH (0.70) DHODHTSHRPDE10ASMN1; SMN2
SCHEMBL2371929 0.85 DHODH (0.61) DHODHTSHRPDE10APTGFRALDH1A1
SCHEMBL2373344 0.83 DHODH (0.82) DHODHTSHRPDE10APTGFR
SCHEMBL2373290 0.83 DHODH (0.59) DHODHTSHRPDE10APTGFRALDH1A1
SCHEMBL2462805 0.83 DHODH (0.57) DHODHPTGFRALDH1A1SMN1; SMN2
SCHEMBL2373336 0.81 DHODH (0.62) DHODHTSHRPDE10APTGFR
SCHEMBL2372758 0.81 DHODH (0.56) DHODHTSHRPDE10APTGFR

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 DHODH 2190/4885TSHR 2692/4885PDE10A 2268/4885

“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.