SCHEMBL4107568

SCHEMBL4107568

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

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MCHR1 Q99705 12/20 0.58
▸ MEN1 O00255 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ CCR3 P51677 1/20 0.45
▸ BMP1 P13497 1/20 0.45
▸ FPR2 P25090 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2D6 P10635 1/20 0.44
▸ CYP3A4 P08684 1/20 0.43

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 0.93 MCHR1 (0.66) MCHR1MEN1KMT2ACYP3A4
SCHEMBL4119675 0.90 MEN1 (0.52) MCHR1MEN1KMT2ACCR3BMP1
SCHEMBL4115328 0.89 MCHR1 (0.61) MCHR1MEN1KMT2ACCR3
SCHEMBL4107405 0.88 MCHR1 (0.60) MCHR1MEN1KMT2A
SCHEMBL4119645 0.88 MCHR1 (0.60) MCHR1MEN1KMT2A
SCHEMBL4114155 0.87 MEN1 (0.49) MCHR1MEN1KMT2ACCR3BMP1
SCHEMBL4107391 0.86 MCHR1 (0.64) MCHR1MEN1KMT2ACYP3A4
SCHEMBL4113690 0.86 MEN1 (0.50) MCHR1MEN1KMT2ACCR3BMP1
SCHEMBL4116381 0.85 MCHR1 (0.58) MCHR1MEN1KMT2A
SCHEMBL4114182 0.83 MCHR1 (0.59) MCHR1MEN1KMT2ACCR3

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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