SCHEMBL4136186

SCHEMBL4136186

CC(C)C[C@H](N)C(=O)N(CCCCNS(=O)(=O)c1ccc(Cl)cc1Cl)C(=O)NC1CCCCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV4 Q9HBA0 6/20 0.39
CA12 O43570 5/20 0.38
CA1 P00915 5/20 0.38
CA2 P00918 5/20 0.38
CA4 P22748 5/20 0.38
CA6 P23280 5/20 0.38
CA5A P35218 5/20 0.38
CA7 P43166 5/20 0.38
CA9 Q16790 5/20 0.38
CA13 Q8N1Q1 5/20 0.38
CA14 Q9ULX7 5/20 0.38
CA5B Q9Y2D0 5/20 0.38
CA3 P07451 1/20 0.38
GAA P10253 2/20 0.37
PTGDR Q13258 1/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
HSD11B1 P28845 2/20 0.36
CCR1 P32246 1/20 0.36
RAB9A P51151 1/20 0.36
TSHR P16473 1/20 0.36

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
SCHEMBL4152609 0.87 TRPV4 (0.40) TRPV4CA12CA1CA2CA4
SCHEMBL4140789 0.86 TRPV4 (0.38) TRPV4GAACCR1TSHR
SCHEMBL5430210 0.85 RAB9A (0.36) TRPV4CA12CA1CA2CA4
SCHEMBL4147711 0.85 TRPV4 (0.39) TRPV4GAACCR1RAB9ATSHR
SCHEMBL4145642 0.83 EPHX2 (0.42) CA12CA1CA9HSD11B1
SCHEMBL4130512 0.82 EPHX2 (0.41) HSD11B1
SCHEMBL4136024 0.79 RAB9A (0.40) TRPV4CA12CA1CA2CA4
SCHEMBL4136028 0.79 RAB9A (0.40) TRPV4CA12CA1CA2CA4
SCHEMBL4132376 0.79 GAA (0.42) CA12CA1CA2CA4CA6
SCHEMBL4131622 0.78 RAB9A (0.40) TRPV4GAAPTGDRPTGDR2HSD11B1

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 2 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 claimed
US-20090105259-A1 Acyclic 1,4-Diamines and Uses Thereof SMITHKLINE BEECHAM CORPORATION 2009-04-23 US 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 1/4885CA12 2237/4885CA1 1033/4885

“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.