SCHEMBL4107138

SCHEMBL4107138

CCN(CC)CCN(CCNC(=O)Nc1cccc(C(F)(F)F)c1)C(=S)Nc1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CNR1 P21554 2/20 0.55
▸ MCHR1 Q99705 3/20 0.54
▸ MAPT P10636 7/20 0.50
▸ NPSR1 Q6W5P4 4/20 0.50
▸ GAA P10253 4/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ IDH1 O75874 2/20 0.49
▸ HTT P42858 6/20 0.48
▸ LMNA P02545 5/20 0.48
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ MEN1 O00255 6/20 0.48
▸ KMT2A Q03164 6/20 0.48
▸ RAB9A P51151 1/20 0.45
▸ XBP1 P17861 1/20 0.45
▸ PAX8 Q06710 1/20 0.45
▸ TP53 P04637 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ NTRK1 P04629 1/20 0.45

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
SCHEMBL4125608 0.86 MEN1 (0.61) CNR1MAPTGAAHTTLMNA
SCHEMBL4116381 0.85 MCHR1 (0.58) CNR1MCHR1MAPTNPSR1GAA
SCHEMBL4107284 0.85 MCHR1 (0.59) MCHR1MAPTNPSR1GAAKDM4E
SCHEMBL4118097 0.84 LMNA (0.51) CNR1MCHR1MAPTNPSR1GAA
SCHEMBL4120327 0.83 LMNA (0.65) MCHR1MAPTNPSR1GAATDP1
SCHEMBL4119645 0.82 MCHR1 (0.60) CNR1MCHR1MAPTGAAHTT
SCHEMBL4114249 0.81 MCHR1 (0.59) CNR1MCHR1MAPTGAAKDM4E
SCHEMBL11797984 0.79 MCHR1 (0.61) MCHR1MAPTNPSR1GAAKDM4E
SCHEMBL4106239 0.78 MCHR1 (0.52) CNR1MCHR1HTTLMNASMN1; SMN2
SCHEMBL4118347 0.77 LMNA (0.56) MCHR1MAPTNPSR1GAATDP1

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 CNR1 3201/4885MCHR1 4128/4885MAPT 1996/4885

“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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