SCHEMBL4136149

SCHEMBL4136149

NC(=O)CCCNC(=O)NC1CCCCC1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.76
EPHX1 P07099 12/20 0.67
KDM4E B2RXH2 1/20 0.62
ALDH1A1 P00352 1/20 0.62

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
SCHEMBL1064217 0.93 EPHX1 (0.77) EPHX2EPHX1
SCHEMBL15224137 0.91 EPHX2 (0.66) EPHX2EPHX1KDM4EALDH1A1
SCHEMBL6872555 0.91 EPHX2 (0.66) EPHX2EPHX1KDM4EALDH1A1
SCHEMBL1065092 0.86 EPHX2 (1.00) EPHX2EPHX1KDM4EALDH1A1
SCHEMBL19420509 0.85 EPHX1 (0.86) EPHX2EPHX1KDM4EALDH1A1
SCHEMBL9750349 0.85 EPHX1 (0.86) EPHX2EPHX1KDM4EALDH1A1
SCHEMBL5596684 0.84 EPHX1 (0.68) EPHX2EPHX1KDM4EALDH1A1
SCHEMBL15224138 0.84 EPHX1 (0.68) EPHX2EPHX1KDM4EALDH1A1
SCHEMBL7985553 0.81 EPHX2 (0.68) EPHX2EPHX1
SCHEMBL1193592 0.81 EPHX1 (0.97) EPHX2EPHX1KDM4EALDH1A1

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
EP-1940785-A2 ACYCLIC 1,4-DIAMINES AND USES THEREOF SmithKline Beecham Corporation (US) 2008-07-09 EP claimed
WO-2007030761-A2 ACYCLIC 1,4-DIAMINES AND USES THEREOF SMITHKLINE BEECHAM CORPORATION (US) 2007-03-15 WO 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 2285/4885EPHX1 1948/4885KDM4E 1551/4885

“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.