SCHEMBL6046937

SCHEMBL6046937

COc1ccc(C(=O)c2nc(N)c3[nH]cnc3n2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 1/20 0.48
ADORA3 P0DMS8 2/20 0.48
MAPT P10636 4/20 0.46
ADORA1 P30542 1/20 0.44
PDPK1 O15530 1/20 0.43
GDA Q9Y2T3 1/20 0.43
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 2/20 0.42
BRAF P15056 2/20 0.41
CYP3A4 P08684 1/20 0.41
MAP3K5 Q99683 1/20 0.41
CDK5 Q00535 2/20 0.40
CDK5R1 Q15078 2/20 0.40
LMNA P02545 2/20 0.40
CDK2 P24941 1/20 0.40
CHRM4 P08173 1/20 0.40
RXFP1 Q9HBX9 2/20 0.39
RAB9A P51151 2/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL134909 0.83 PDPK1 (0.49) BRD4ADORA3ADORA1PDPK1GDA
SCHEMBL7640806 0.80 KMT2A (0.44) BRD4MAPTMEN1KMT2ANPC1
SCHEMBL27461919 0.73 GDA (0.58) PDPK1GDAMAP3K5LMNACDK2
SCHEMBL29509029 0.73 GDA (0.58) PDPK1GDAMAP3K5LMNACDK2
SCHEMBL17868331 0.73 RXFP1 (0.48) MAPTMEN1KMT2ANPC1CDK5
SCHEMBL30107648 0.72 GDA (0.56) PDPK1GDAMAP3K5LMNACDK2
SCHEMBL1422155 0.72 MAPT (0.51) ADORA3MAPTADORA1PDPK1GDA
SCHEMBL5806328 0.72 CA1 (0.50) BRD4MAPTMEN1KMT2ANPC1
SCHEMBL31435111 0.72 GDA (0.51) PDPK1GDAMAP3K5LMNA
SCHEMBL28083643 0.71 PDPK1 (0.47) PDPK1GDALMNACDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111253570-A Amine oligomer curing agent with hydrogen bond structure and preparation method thereof 刘云晖 2020-06-09 CN disclosed
EP-1105525-B1 A PROCESS FOR PREPARING PEPTIDE NUCLEIC ACID PROBE USING POLYMERIC PHOTOACID GENERATOR SAMSUNG ELECTRONICS CO LTD (KR) 2006-11-02 EP disclosed
US-6660479-B2 Derivatizing surface of a solid matrix and attaching linker with acid- labile protecting group on solid matrix; coating solid matrix with polymeric photoacid generator(PAG); exposing solid matrix thus coated to light to generate acid; reacting SAMSUNG ELECTRONICS CO., LTD. (KR) 2003-12-09 US disclosed
US-6465650-B1 INTERMEDIATE STEPS IN PREPARING PEPTIDE NUCLEIC ACIDS AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2002-10-15 US disclosed
US-20020122874-A1 Process for preparing peptide nucleic acid probe using polymeric photoacid generator SAMSUNG ELECTRONICS CO., LTD. (KR) 2002-09-05 US disclosed
US-6359125-B1 DERIVATIZING SURFACE OF SOLID MATRIX WITH AMINOALKYLOXYSILANE AND ATTACHING LINKER WITH ACID-LABILE PROTECTING GROUP TO AMINE GROUP ON MATRIX, COATING MATRIX WITH POLYMERIC PHOTOACID GENERATOR, EXPOSING TO LIGHT, ATTACHING PEPTIDE NUCLEIC ACID SAMSUNG ELECTRONICS CO., LTD. (KR) 2002-03-19 US disclosed