SCHEMBL4192205

SCHEMBL4192205

O=C(N[C@@H](CC1CCCCC1)C(=O)NCC1CN(S(=O)(=O)c2ccc(Cl)cc2Cl)CCO1)c1cc2ccccc2s1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 2/20 0.47
TACR2 P21452 3/20 0.40
PPM1D O15297 1/20 0.39
KMT2A Q03164 3/20 0.39
MEN1 O00255 1/20 0.39
CCR1 P32246 1/20 0.39
F10 P00742 2/20 0.38
REN P00797 1/20 0.38
CTSK P43235 3/20 0.38
MMP1 P03956 1/20 0.38
MMP2 P08253 1/20 0.38
MMP3 P08254 1/20 0.38
PIN1 Q13526 1/20 0.38
CTSL P07711 1/20 0.38
CTSS P25774 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ACLY P53396 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
SCHEMBL5482788 0.91 KMT2A (0.44) TRPV4TACR2PPM1DKMT2AMEN1
SCHEMBL4179292 0.90 TRPV4 (0.51) TRPV4TACR2KMT2AMEN1CCR1
SCHEMBL4185675 0.89 TRPV4 (0.60) TRPV4TACR2CCR1F10CTSK
SCHEMBL4185931 0.89 TRPV4 (0.60) TRPV4TACR2CCR1F10CTSK
SCHEMBL4178713 0.89 TRPV4 (0.60) TRPV4TACR2CCR1F10CTSK
SCHEMBL4192169 0.89 TRPV4 (0.51) TRPV4TACR2CCR1F10CTSK
SCHEMBL4188230 0.89 TRPV4 (0.48) TRPV4TACR2CCR1F10CTSK
SCHEMBL4179196 0.88 TACR2 (0.44) TACR2RENCTSKCTSLCTSS
SCHEMBL4188976 0.88 TRPV4 (0.49) TRPV4KMT2ACCR1F10CTSK
SCHEMBL4185919 0.88 TRPV4 (0.49) TRPV4KMT2AMEN1CCR1F10

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 99/4885PPM1D 3166/4885

“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.