SCHEMBL4119675

SCHEMBL4119675

COc1ccc(NC(=O)NCCN(CCN(C)C)C(=O)Nc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.52
▸ KMT2A Q03164 1/20 0.52
▸ RAF1 P04049 1/20 0.48
▸ ATM Q13315 3/20 0.47
▸ MCHR1 Q99705 3/20 0.47
▸ FPR2 P25090 3/20 0.47
▸ CCR3 P51677 3/20 0.47
▸ BMP1 P13497 1/20 0.47
▸ CNR1 P21554 2/20 0.44
▸ CASR P41180 1/20 0.44

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
SCHEMBL4113690 0.94 MEN1 (0.50) MEN1KMT2ARAF1ATMMCHR1
SCHEMBL4112186 0.92 MEN1 (0.60) MEN1KMT2ARAF1MCHR1CNR1
SCHEMBL4107568 0.90 MCHR1 (0.58) MEN1KMT2AMCHR1FPR2CCR3
SCHEMBL4114155 0.89 MEN1 (0.49) MEN1KMT2ARAF1MCHR1FPR2
SCHEMBL4107298 0.88 MEN1 (0.55) MEN1KMT2AATMMCHR1CCR3
SCHEMBL4117727 0.87 CNR1 (0.60) MEN1KMT2AMCHR1CNR1
SCHEMBL4118355 0.85 MEN1 (0.55) MEN1KMT2AMCHR1CNR1
SCHEMBL4119938 0.84 TP53 (0.54) MEN1KMT2AMCHR1CNR1
SCHEMBL4125793 0.84 EPHX2 (0.53) CCR3
SCHEMBL4116393 0.84 EPHX2 (0.52) CCR3

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 MEN1 4167/4885KMT2A 2720/4885RAF1 1059/4885

“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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