SCHEMBL8592144

SCHEMBL8592144

Nc1nc(CC(=O)O)nc2nc[nH]c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.53
▸ GDA Q9Y2T3 1/20 0.53
▸ CDK2 P24941 2/20 0.47
▸ KDR P35968 1/20 0.45
▸ AURKB Q96GD4 1/20 0.45
▸ CYP1A2 P05177 2/20 0.44
▸ MGMT P16455 2/20 0.43
▸ DPP4 P27487 1/20 0.42
▸ PI4KA P42356 2/20 0.42
▸ PI4K2B Q8TCG2 2/20 0.42
▸ PI4K2A Q9BTU6 2/20 0.42
▸ PI4KB Q9UBF8 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ DRD3 P35462 1/20 0.42
▸ XDH P47989 1/20 0.42
▸ LRRK2 Q5S007 1/20 0.42
▸ PNP P00491 1/20 0.41
▸ CYP2C19 P33261 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ GABRR1 P24046 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
SCHEMBL31239223 1.00 PDPK1 (0.53) PDPK1GDACDK2KDRAURKB
SCHEMBL17165348 0.88 GDA (0.53) PDPK1GDACDK2KDRAURKB
SCHEMBL10361596 0.80 PDPK1 (0.45) PDPK1GDACDK2KDRAURKB
SCHEMBL9176120 0.80 PDPK1 (0.59) PDPK1GDACDK2KDRAURKB
SCHEMBL5091266 0.80 PDPK1 (0.40) PDPK1GDACDK2KDRAURKB
SCHEMBL31239225 0.80 KDR (0.41) PDPK1GDACDK2KDRAURKB
SCHEMBL11222102 0.80 PDPK1 (0.63) PDPK1GDACDK2KDRAURKB
SCHEMBL8594396 0.79 PDPK1 (0.39) PDPK1GDACDK2KDRAURKB
SCHEMBL17060283 0.78 PDPK1 (0.61) PDPK1GDACDK2KDRAURKB
SCHEMBL31239073 0.78 KDR (0.42) CDK2KDRAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0792283-A1 SYNTHESIS OF PEPTIDE NUCLEIC ACIDS (PNAs) AND ANALOGUES VIA SUBMONOMER APPROACH CHIRON CORPORATION (US) 1997-09-03 — — EP claimed
WO-1996015143-A1 SYNTHESIS OF PEPTIDE NUCLEIC ACIDS (PNAs) AND ANALOGUES VIA SUBMONOMER APPROACH CHIRON CORPORATION (US) 1996-05-23 — — WO claimed
EP-0639607-B1 Method and apparatus for degradation and sequencing of polymers which sequentially eliminate terminal residues PERSEPTIVE BIOSYSTEMS INC (US) 1998-01-07 — — EP disclosed
EP-0816379-A2 DNA binding oligomers BAYER AG (DE) 1998-01-07 — — EP disclosed
US-5527675-A Method for degradation and sequencing of polymers which sequentially eliminate terminal residues MILLIPORE CORPORATION (US) 1996-06-18 — — US disclosed
EP-0639607-A2 Method and apparatus for degradation and sequencing of polymers which sequentially eliminate terminal residues PERSEPTIVE BIOSYSTEMS, INC. (US) 1995-02-22 — — EP disclosed
EP-0586474-A1 PEPTIDE NUCLEIC ACIDS BUCHARDT, Ole (DK) 1994-03-16 — — EP disclosed
WO-1992020702-A1 PEPTIDE NUCLEIC ACIDS BUCHARDT OLE (DK) 1992-11-26 — — WO disclosed
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