SCHEMBL6046938

SCHEMBL6046938

COc1ccc(C(=O)n2cnc3c(N)ncnc32)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.59
PI4K2B Q8TCG2 2/20 0.59
PI4K2A Q9BTU6 2/20 0.59
PI4KB Q9UBF8 2/20 0.59
NSD3 Q9BZ95 1/20 0.54
KMT2A Q03164 6/20 0.53
ALDH1A1 P00352 1/20 0.53
KLK7 P49862 1/20 0.53
KLK14 Q9P0G3 1/20 0.53
KLK5 Q9Y337 1/20 0.53
GSK3B P49841 1/20 0.51
CHKA P35790 2/20 0.50
EGFR P00533 1/20 0.43
ADORA2A P29274 1/20 0.43
ADORA1 P30542 1/20 0.43
LMNA P02545 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
KDM4E B2RXH2 1/20 0.42
XDH P47989 1/20 0.42
AHCY P23526 1/20 0.41

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
SCHEMBL134910 0.82 EGFR (0.61) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL3630349 0.77 GSK3B (0.65) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL21066915 0.74 EGFR (0.65) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL18292155 0.74 PI4KA (1.00) PI4KAPI4K2BPI4K2API4KBNSD3
SCHEMBL27599134 0.74 GSK3B (0.69) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL2346678 0.73 GSK3B (0.67) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL27991603 0.72 PI4KA (0.59) PI4KAPI4K2BPI4K2API4KBNSD3
Hydrochloric Acid SCHEMBL29003046 0.71 GSK3B (0.65) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL1422156 0.71 NSD3 (0.70) PI4KAPI4K2BPI4K2API4KBNSD3
SCHEMBL5857627 0.71 GSK3B (0.53) PI4KAPI4K2BPI4K2API4KBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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