SCHEMBL5084584

SCHEMBL5084584

CNc1cc(N)c(NC)cc1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.46
PTK2 Q05397 1/20 0.35
EGFR P00533 1/20 0.33
AOC1 P19801 1/20 0.32
AOC3 Q16853 1/20 0.32
CYP3A4 P08684 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
ALDH1A1 P00352 5/20 0.31
KDM4E B2RXH2 3/20 0.31
GLA P06280 2/20 0.31
GAA P10253 2/20 0.31
HSD17B10 Q99714 3/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
L3MBTL1 Q9Y468 2/20 0.31
CYP1A2 P05177 1/20 0.31
ALOX15 P16050 1/20 0.31
CASP7 P55210 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL21154376 0.94 PTK2 (0.47) PRKCIPTK2EGFRAOC1AOC3
SCHEMBL5085231 0.90 PRKCI (0.45) PRKCIPTK2EGFRAOC1AOC3
SCHEMBL6153206 0.87 PTK2 (0.44) PRKCIPTK2AOC1AOC3CYP3A4
SCHEMBL5605028 0.85 PRKCI (0.42) PRKCIPTK2EGFR
SCHEMBL5605449 0.85 PRKCI (0.42) PRKCIPTK2EGFR
SCHEMBL5606146 0.83 PRKCI (0.41) PRKCI
SCHEMBL21154375 0.83 PRKCI (0.41) PRKCIPTK2
SCHEMBL6983173 0.83 TSHR (0.50) PRKCICYP3A4TSHRMAPK1ALDH1A1
SCHEMBL5605747 0.83 PRKCI (0.41) PRKCI
SCHEMBL932424 0.81 GAA (0.46) PRKCICYP3A4TSHRMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1462471-B1 Dielectric films and materials therefor DAICEL CHEM (JP) 2008-07-30 EP disclosed
EP-1462470-B1 Dielectric films and materials therefor DAICEL CHEM (JP) 2007-08-29 EP disclosed
US-20070078256-A1 Prepolymers, prepolymer compositions, high-molecular-weight polymers with pore structure, and dielectric films DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-04-05 US disclosed
US-7186454-B2 Dielectric films and materials therefor DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2007-03-06 US disclosed
US-20060241275-A1 Dielectric films and materials therefor NAGANO SHINYA 2006-10-26 US disclosed
US-7090925-B2 Dielectric films and materials therefor DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2006-08-15 US disclosed
EP-1683822-A1 PREPOLYMER, PREPOLYMER COMPOSITION, HIGH MOLECULAR WEIGHT POLYMER HAVING STRUCTURE CONTAINING HOLE AND ELECTRICALLY INSULATING FILM Daicel Chemical Industries, Ltd. (JP) 2006-07-26 EP disclosed
US-20040192880-A1 Dielectric films and materials therefor DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-09-30 US disclosed
EP-1462471-A1 Dielectric films and materials thereof Daicel Chemical Industries, Ltd. (JP) 2004-09-29 EP disclosed
EP-1462470-A1 Dielectric films and materials therefor Daicel Chemical Industries, Ltd. (JP) 2004-09-29 EP disclosed
US-20040175858-A1 Dielectric films and materials therefor DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2004-09-09 US disclosed