SCHEMBL6479147

SCHEMBL6479147

CC(C#N)(c1ccc(Cl)cc1)c1ccc(-n2ncc(=O)[nH]c2=O)cc1Cl

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.54
NR1I2 O75469 1/20 0.54
KMT2A Q03164 1/20 0.54
P2RX7 Q99572 10/20 0.41
ABCB11 O95342 1/20 0.38
THRB P10828 8/20 0.37
THRA P10827 3/20 0.37
KDM4E B2RXH2 1/20 0.35
NPC1 O15118 1/20 0.35
S1PR4 O95977 1/20 0.35
ALDH1A1 P00352 1/20 0.35
HSP90AA1 P07900 1/20 0.35
MAPT P10636 1/20 0.35
S1PR1 P21453 1/20 0.35
MAPK1 P28482 1/20 0.35
AGTR1 P30556 1/20 0.35
OPRK1 P41145 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL9823472 0.92 MEN1 (0.45) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL10419884 0.89 MEN1 (0.47) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL10421420 0.88 KMT2A (0.57) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL6479424 0.87 MEN1 (0.59) MEN1NR1I2KMT2AP2RX7THRB
SCHEMBL5560395 0.87 MEN1 (0.43) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL7545405 0.86 MEN1 (0.55) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL10670462 0.85 MEN1 (0.50) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL10667155 0.85 MEN1 (0.50) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL10420835 0.84 MEN1 (0.49) MEN1NR1I2KMT2AP2RX7ABCB11
SCHEMBL10421482 0.84 MEN1 (0.45) MEN1NR1I2KMT2AP2RX7THRB

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6951857-B2 Interleukins; cytokines; for treating eosinophil-dependent inflammatory disease/bronchial asthma FREYNE EDDY JEAN EDGARD 2005-10-04 US disclosed
US-6743792-B2 ANTIINFLAMMATORY AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 2004-06-01 US disclosed
US-20030220331-A1 Interleukins; cytokines; for treating eosinophil-dependent inflammatory disease/bronchial asthma FREYNE EDDY JEAN EDGARD (BE) 2003-11-27 US disclosed
US-20020042416-A1 Antiinflammatory agents FREYNE EDDY JEAN EDGARD (BE) 2002-04-11 US disclosed
EP-1003729-A1 6-AZAURACIL DERIVATIVES AS IL-5 INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 2000-05-31 EP disclosed
WO-1999002504-A1 6-AZAURACIL DERIVATIVES AS IL-5 INHIBITORS JANSSEN PHARMACEUTICA N.V. (BE) 1999-01-21 WO disclosed
EP-0170316-B1 ALPHA-ARYL-4-(4,5-DIHYDRO-3,5-DIOXO-1,2,4-TRIAZIN-2(3H)-YL)BENZENEACETONITRILES JANSSEN PHARMACEUTICA N.V. (BE) 1990-05-30 EP disclosed
US-4778887-A ANTIPROTOZOA AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1988-10-18 US disclosed
US-4631278-A Anti-protozoal α-aryl-4-(4,5-dihydro-3,5-dioxo-1,2,4-triazin-2(3H)-yl)-benzeneacetonitrile derivatives, pharmaceutical compositions, and method of use therefor JANSSEN PHARMACEUTICA N.V. (BE) 1986-12-23 US disclosed
EP-0170316-A2 alpha-Aryl-4-(4,5-dihydro-3,5-dioxo-1,2,4-triazin-2(3H)-yl)benzeneacetonitriles JANSSEN PHARMACEUTICA N.V. (BE) 1986-02-05 EP 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 (2 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-20020042416-A1 Antiinflammatory agents CCR1, CCR6, FPR1 MEN1 4743/4885NR1I2 384/4885KMT2A 4147/4885
US-20030220331-A1 Interleukins; cytokines; for treating eosinophil-dependent inflammatory disease/bronchial asthma IL6, CCR1, CCR6 MEN1 4804/4885NR1I2 624/4885KMT2A 3682/4885

“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.