SCHEMBL4124267

SCHEMBL4124267

COc1cccc(NC(=S)N(CCCN(C)C)CCNC(=S)Nc2ccc(Cl)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.57
▸ POLB P06746 2/20 0.57
▸ ACHE P22303 1/20 0.52
▸ MEN1 O00255 4/20 0.52
▸ KMT2A Q03164 4/20 0.52
▸ TDP1 Q9NUW8 1/20 0.52
▸ CRHBP P24387 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ MAPT P10636 3/20 0.48
▸ HTT P42858 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ ALPL P05186 1/20 0.48
▸ ALOX12 P18054 1/20 0.48
▸ QPCT Q16769 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.47
▸ IDO1 P14902 1/20 0.47
▸ UTS2R Q9UKP6 2/20 0.47

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
SCHEMBL4120282 0.86 MEN1 (0.60) LMNAPOLBACHEMEN1KMT2A
SCHEMBL4114160 0.83 ALDH1A1 (0.59) LMNAMEN1KMT2ATDP1CRHBP
SCHEMBL4119968 0.83 ALDH1A1 (0.61) LMNAMEN1KMT2ATDP1CRHBP
SCHEMBL4114264 0.80 LMNA (0.79) LMNAPOLBACHEMEN1KMT2A
SCHEMBL4118347 0.72 LMNA (0.56) LMNAPOLBMEN1KMT2ATDP1
SCHEMBL4115173 0.71 MEN1 (0.80) LMNAPOLBACHEMEN1KMT2A
SCHEMBL5053688 0.69 SMN1; SMN2 (0.49) LMNAPOLBMEN1KMT2ACRHBP
SCHEMBL5053666 0.69 SMN1; SMN2 (0.49) LMNAPOLBMEN1KMT2ACRHBP
SCHEMBL27941633 0.69 MTNR1A (0.64) LMNAPOLBMEN1KMT2ACRHBP
SCHEMBL16566535 0.69 MAPT (0.69) MEN1KMT2AMAPTALDH1A1ALOX12

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 LMNA 3428/4885POLB 2764/4885ACHE 4505/4885

“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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