SCHEMBL4127541

SCHEMBL4127541

CC(C)C[C@H](N)C(=O)N(CCCCNS(=O)(=O)c1ccc(F)cc1C(F)(F)F)C(=O)N(C)C1CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 1/20 0.37
CNR2 P34972 14/20 0.36
CNR1 P21554 6/20 0.35
HSD11B1 P28845 1/20 0.35
NPY5R Q15761 2/20 0.34
F2 P00734 2/20 0.33

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
SCHEMBL4139223 0.99 CNR2 (0.36) EPHX2CNR2CNR1HSD11B1NPY5R
SCHEMBL4145642 0.89 EPHX2 (0.42) EPHX2CNR2CNR1HSD11B1
SCHEMBL4140796 0.89 CNR2 (0.36) EPHX2CNR2CNR1HSD11B1
SCHEMBL4130512 0.88 EPHX2 (0.41) EPHX2CNR2CNR1HSD11B1NPY5R
SCHEMBL4135746 0.88 CNR2 (0.39) EPHX2CNR2CNR1
SCHEMBL4139936 0.88 CNR2 (0.37) EPHX2CNR2CNR1HSD11B1
SCHEMBL4135415 0.87 CNR2 (0.35) EPHX2CNR2CNR1HSD11B1
SCHEMBL4137114 0.86 CNR2 (0.36) EPHX2CNR2CNR1HSD11B1
SCHEMBL5429673 0.86 CNR2 (0.36) EPHX2CNR2CNR1HSD11B1
SCHEMBL5439595 0.85 CNR2 (0.37) EPHX2CNR2CNR1HSD11B1

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 EPHX2 2285/4885CNR2 57/4885CNR1 67/4885

“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.