SCHEMBL5405972

SCHEMBL5405972

O=C1C=C(c2ccc3ccccc3c2C2=CC(=O)NC2=O)C(=O)N1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNMT1 P26358 1/20 0.45
PRKCB P05771 8/20 0.41
PRKCG P05129 7/20 0.41
PRKCA P17252 7/20 0.41
PRKCE Q02156 7/20 0.41
PRKD3 O94806 6/20 0.41
PRKCH P24723 6/20 0.41
PRKCI P41743 6/20 0.41
PRKCQ Q04759 6/20 0.41
PRKCZ Q05513 6/20 0.41
PRKCD Q05655 6/20 0.41
PRKD1 Q15139 6/20 0.41
ALDH1A1 P00352 3/20 0.40
CYP1A2 P05177 2/20 0.40
HPGD P15428 2/20 0.40
CYP2C19 P33261 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HTT P42858 1/20 0.40
CDK5 Q00535 1/20 0.40

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
SCHEMBL31669073 0.83 CYP1A2 (0.42) DNMT1PRKCBPRKCGPRKCAPRKCE
SCHEMBL11882241 0.83 PRKCB (0.40) DNMT1PRKCBPRKCGPRKCAPRKCE
SCHEMBL9228115 0.83 CYP1A2 (0.42) DNMT1PRKCBPRKCGPRKCAPRKCE
SCHEMBL2544260 0.81 PTPN1 (0.53) DNMT1PRKCBPRKCGPRKCAPRKCE
SCHEMBL9614313 0.79 HPRT1 (0.44) PRKCBPRKCGPRKCAPRKCEPRKD3
SCHEMBL1305138 0.79 SIRT2 (0.40) DNMT1PRKCBPRKCGPRKCAPRKCE
SCHEMBL10714445 0.79 PTPN1 (0.50) DNMT1PRKCBPRKCGPRKCAPRKCE
SCHEMBL8413954 0.77 PARP1 (0.42) DNMT1PRKCBPRKCGPRKCAPRKCE
SCHEMBL3182292 0.77 ALDH1A1 (0.44) PRKCBPRKCGPRKCAPRKCEPRKD3
SCHEMBL27925210 0.77 GSK3B (0.38) DNMT1PRKCBPRKCGPRKCAPRKCE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238489-B2 Identification of sortase gene THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2007-07-03 US disclosed
EP-1646486-A2 MEDICAL DEVICES AND PROCESSES FOR PREPARING SAME Boston Scientific Limited (BB) 2006-04-19 EP disclosed
WO-2005007375-A2 MEDICAL DEVICES AND PROCESSES FOR PREPARING SAME BOSTON SCIENTIFIC LIMITED (BB) 2005-01-27 WO disclosed
EP-0422379-A2 Thermosetting resin composition, resin sheet, prepreg and laminated sheet NITTO DENKO CORPORATION (JP) 1991-04-17 EP disclosed