SCHEMBL5950255

SCHEMBL5950255

O=C(O)C1CCCN1C(=O)NC1CCCCC1

nearest known ligand 0.73

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.73
SMN1; SMN2 Q16637 1/20 0.73
POLB P06746 2/20 0.59
TSHR P16473 3/20 0.58
NPSR1 Q6W5P4 1/20 0.58
ALDH1A1 P00352 3/20 0.56
HTT P42858 1/20 0.53
KMT2A Q03164 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
THRB P10828 1/20 0.49
ALOX12 P18054 1/20 0.49

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
SCHEMBL6534174 1.00 KDM4E (0.73) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL7670891 0.87 KDM4E (0.69) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL7837671 0.87 KDM4E (0.69) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL7670889 0.85 KDM4E (0.71) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL7837668 0.85 KDM4E (0.71) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL7336982 0.83 KDM4E (0.53) KDM4ESMN1; SMN2POLBNPSR1ALDH1A1
SCHEMBL7405457 0.83 KDM4E (0.53) KDM4ESMN1; SMN2POLBNPSR1ALDH1A1
SCHEMBL27738022 0.79 KDM4E (0.48) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL5736424 0.77 KDM4E (0.66) KDM4ESMN1; SMN2POLBTSHRNPSR1
SCHEMBL18051877 0.77 KDM4E (0.61) KDM4ESMN1; SMN2POLBTSHRNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060160856-A1 Diarylurea derivatives and their use as chloride channel blockers NEUROSEARCH A/S (DK) 2006-07-20 US claimed
JP-2005538152-A 2005-12-15 JP claimed
EP-1537075-A2 DIARYLUREA DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2005-06-08 EP claimed
WO-2004022529-A2 DIARYLUREA DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2004-03-18 WO claimed
US-20060160856-A1 Diarylurea derivatives and their use as chloride channel blockers NEUROSEARCH A/S (DK) 2006-07-20 US disclosed
EP-1537075-A2 DIARYLUREA DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2005-06-08 EP disclosed
WO-2004022529-A2 DIARYLUREA DERIVATIVES AND THEIR USE AS CHLORIDE CHANNEL BLOCKERS NEUROSEARCH A/S (DK) 2004-03-18 WO disclosed
US-20020007075-A1 Ureas of N-heterocyclic carboxylic acids and carboxylic acid isosteres GLIAMED, INC. 2002-01-17 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 (2 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-20020007075-A1 Ureas of N-heterocyclic carboxylic acids and carboxylic acid isosteres OTC, CPS1, ABAT KDM4E 2622/4885SMN1; SMN2 573/4885POLB 2320/4885
US-20060160856-A1 Diarylurea derivatives and their use as chloride channel blockers KIT, ORAI1, CACNA1C KDM4E 1042/4885SMN1; SMN2 2548/4885POLB 3428/4885

“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.