SCHEMBL4107405

SCHEMBL4107405

CCN(CC)CCN(CCNC(=O)Nc1ccc(N(CC)CC)cc1)C(=O)Nc1ccc(C(F)(F)F)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 5/20 0.60
▸ MEN1 O00255 5/20 0.55
▸ KMT2A Q03164 5/20 0.55
▸ NOX1 Q9Y5S8 3/20 0.48
▸ NPC1 O15118 2/20 0.48
▸ RAB9A P51151 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ THRB P10828 1/20 0.48
▸ CNR1 P21554 2/20 0.46
▸ GAA P10253 2/20 0.46
▸ MAPT P10636 2/20 0.46
▸ HTT P42858 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ EPHX2 P34913 1/20 0.43
▸ MTOR P42345 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ MCL1 Q07820 1/20 0.42
▸ NAMPT P43490 1/20 0.41
▸ NFKB1 P19838 1/20 0.41

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
SCHEMBL4118376 0.95 MCHR1 (0.66) MCHR1MEN1KMT2AALDH1A1THRB
SCHEMBL4118355 0.92 MEN1 (0.55) MCHR1MEN1KMT2ANOX1NPC1
SCHEMBL4114249 0.91 MCHR1 (0.59) MCHR1MEN1KMT2ANOX1NPC1
SCHEMBL4115328 0.91 MCHR1 (0.61) MCHR1MEN1KMT2ARAB9AALDH1A1
SCHEMBL4120523 0.90 MCHR1 (0.53) MCHR1MEN1KMT2ANOX1NPC1
SCHEMBL4119645 0.90 MCHR1 (0.60) MCHR1MEN1KMT2ACNR1GAA
SCHEMBL4107391 0.88 MCHR1 (0.64) MCHR1MEN1KMT2AALDH1A1THRB
SCHEMBL4107568 0.88 MCHR1 (0.58) MCHR1MEN1KMT2A
SCHEMBL4116381 0.87 MCHR1 (0.58) MCHR1MEN1KMT2ARAB9AALDH1A1
SCHEMBL5706056 0.85 MCHR1 (0.48) MCHR1MEN1KMT2ANOX1NPC1

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-20090118330-A1 Diurea derivatives ACTIVE BIOTECH AB (SE) 2009-05-07 — — US disclosed
EP-1711175-A1 DIUREA DERIVATIVES Active Biotech AB (SE) 2006-10-18 — — EP disclosed
WO-2005074919-A1 DIUREA DERIVATIVES ACTIVE BIOTECH AB (SE) 2005-08-18 — — 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-20090118330-A1 Diurea derivatives IL2, CASP2, MAVS MCHR1 4128/4885MEN1 4167/4885KMT2A 2720/4885

“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.

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