SCHEMBL4114216

SCHEMBL4114216

Cc1ccc(CN(CCNC(=O)Nc2ccc(C(F)(F)F)cc2)C(=O)Nc2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.55
▸ KMT2A Q03164 1/20 0.55
▸ CNR1 P21554 2/20 0.52
▸ MTOR P42345 4/20 0.50
▸ MCHR1 Q99705 1/20 0.49
▸ NPC1 O15118 2/20 0.47
▸ NAMPT P43490 1/20 0.46
▸ ALDH1A1 P00352 1/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46
▸ EPHX2 P34913 1/20 0.46
▸ CCR3 P51677 1/20 0.45
▸ RAF1 P04049 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HTR5A P47898 1/20 0.42

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
SCHEMBL4108817 0.95 MEN1 (0.50) MEN1KMT2ACNR1MTORMCHR1
SCHEMBL4119232 0.90 CNR1 (0.50) MEN1KMT2ACNR1MTORNPC1
SCHEMBL4113873 0.89 CNR1 (0.67) MEN1KMT2ACNR1MTORMCHR1
SCHEMBL4117599 0.89 CNR1 (0.67) MEN1KMT2ACNR1MTORMCHR1
SCHEMBL4124108 0.89 MTOR (0.61) MEN1KMT2ACNR1MTORMCHR1
SCHEMBL4118998 0.84 CNR1 (0.61) MEN1KMT2ACNR1MTORALDH1A1
SCHEMBL4112186 0.81 MEN1 (0.60) MEN1KMT2ACNR1MTORMCHR1
SCHEMBL4118376 0.80 MCHR1 (0.66) MEN1KMT2ACNR1MTORMCHR1
SCHEMBL4115055 0.79 MEN1 (0.51) MEN1KMT2ACNR1MTORMCHR1
SCHEMBL4111552 0.79 MEN1 (0.56) MEN1KMT2ACNR1MTORMCHR1

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 2720/4885CNR1 3201/4885

“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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