SCHEMBL4135639

SCHEMBL4135639

CC(C)C[C@H](NC[C@@H](O)CCNS(=O)(=O)c1ccc(Cl)cc1Cl)C(N)=O

nearest known ligand 0.45

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 18/20 0.45
CCR1 P32246 1/20 0.39
ITGA1 P56199 1/20 0.38

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
SCHEMBL3915576 0.91 RAB9A (0.42) TRPV4ITGA1
Hydrochloric Acid SCHEMBL4136144 0.85 CCR1 (0.45) TRPV4CCR1
SCHEMBL4140203 0.82 ADAM17 (0.42) TRPV4CCR1
SCHEMBL4135643 0.82 TRPV4 (0.47) TRPV4
SCHEMBL4136296 0.81 RAB9A (0.45) TRPV4
SCHEMBL4135954 0.78 CTSL (0.43) TRPV4
SCHEMBL4131127 0.77 RAB9A (0.39) TRPV4
SCHEMBL4135952 0.76 TRPV4 (0.41) TRPV4ITGA1
SCHEMBL3915580 0.72 RAB9A (0.42) TRPV4ITGA1
SCHEMBL4777734 0.72 TRPV4 (0.55) TRPV4CCR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof SMITHKLINE BEECHAM CORPORATION 2009-04-23 US disclosed
EP-1940785-A2 ACYCLIC 1,4-DIAMINES AND USES THEREOF SmithKline Beecham Corporation (US) 2008-07-09 EP disclosed
WO-2007030761-A2 ACYCLIC 1,4-DIAMINES AND USES THEREOF SMITHKLINE BEECHAM CORPORATION (US) 2007-03-15 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-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof TRPV4, TRPC4, TRPV1 TRPV4 1/4885CCR1 766/4885ITGA1 3929/4885

“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.