SCHEMBL4188230

SCHEMBL4188230

O=C(N[C@@H](CCc1ccccc1)C(=O)NCC1CN(S(=O)(=O)c2ccc(Cl)cc2Cl)CCO1)c1cc2ccccc2s1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 3/20 0.48
TACR2 P21452 9/20 0.41
CTSK P43235 1/20 0.39
ACLY P53396 1/20 0.39
CTSB P07858 1/20 0.39
CTSS P25774 1/20 0.39
F10 P00742 1/20 0.39
PIN1 Q13526 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A4 P31645 1/20 0.38
CCR1 P32246 1/20 0.38
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37

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
SCHEMBL4179292 0.92 TRPV4 (0.51) TRPV4TACR2CTSKACLYCTSB
SCHEMBL4192169 0.91 TRPV4 (0.51) TRPV4TACR2CTSKACLYCTSB
SCHEMBL4188976 0.90 TRPV4 (0.49) TRPV4CTSKACLYCTSBCTSS
SCHEMBL4178713 0.90 TRPV4 (0.60) TRPV4TACR2CTSKACLYCTSB
SCHEMBL4185675 0.90 TRPV4 (0.60) TRPV4TACR2CTSKACLYCTSB
SCHEMBL4185931 0.90 TRPV4 (0.60) TRPV4TACR2CTSKACLYCTSB
SCHEMBL5493100 0.89 TRPV4 (0.58) TRPV4TACR2CTSKACLYCTSB
SCHEMBL4192205 0.89 TRPV4 (0.47) TRPV4TACR2CTSKACLYCTSS
SCHEMBL4192463 0.88 TRPV4 (0.45) TRPV4TACR2ACLYF10PIN1
SCHEMBL4185919 0.88 TRPV4 (0.49) TRPV4CTSKACLYCTSBCTSS

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
US-20090124619-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-05-14 US claimed
EP-1869026-A1 NOVEL COMPOUNDS SmithKline Beecham Corporation (US) 2007-12-26 EP claimed
WO-2006105475-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-10-05 WO claimed
US-20090124619-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION 2009-05-14 US disclosed
EP-1869026-A1 NOVEL COMPOUNDS SmithKline Beecham Corporation (US) 2007-12-26 EP disclosed
WO-2006105475-A1 NOVEL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2006-10-05 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-20090124619-A1 NOVEL COMPOUNDS TRPV4, TRPC4, TRPV1 TRPV4 1/4885TACR2 99/4885CTSK 1738/4885

“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.