SCHEMBL8675770

SCHEMBL8675770

O=C(c1ccccc1)N(C(=O)c1ccccc1)c1ncnc2[nH]cnc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.42
BRD4 O60885 1/20 0.40
LMNA P02545 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
HTT P42858 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NPC1 O15118 1/20 0.38
CYP1A2 P05177 1/20 0.38
HIF1A Q16665 1/20 0.38
ADORA3 P0DMS8 4/20 0.37
PDPK1 O15530 1/20 0.37
TMIGD3 P0DMS9 1/20 0.37
NT5C2 P49902 2/20 0.36
NT5E P21589 1/20 0.36
POLB P06746 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TTBK1 Q5TCY1 1/20 0.35
TTBK2 Q6IQ55 1/20 0.35

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
SCHEMBL2623135 0.86 KDM4E (0.39) BRD4LMNAHTTRAB9ASMN1; SMN2
SCHEMBL8045436 0.82 BRD4 (0.36) NPSR1BRD4ALDH1A1HTTPDPK1
SCHEMBL18526360 0.80 ADORA3 (0.39) NPSR1BRD4ALDH1A1HPGDHTT
SCHEMBL8675772 0.77 EGFR (0.56) BRD4LMNAALDH1A1HPGDHTT
SCHEMBL13667389 0.77 EGLN1 (0.43) ALDH1A1HPGDHTTRAB9ASMN1; SMN2
SCHEMBL28929154 0.75 POLB (0.50) BRD4LMNAALDH1A1HPGDHTT
SCHEMBL23123 0.72 BRD4 (0.64) NPSR1BRD4HTTRAB9ANPC1
Adenine SCHEMBL502574 0.72 PARP1 (0.47) BRD4PDPK1POLBHSD17B10EGFR
SCHEMBL8502760 0.72 CSF1R (0.60) ALDH1A1HTTEGFRCSF1R
SCHEMBL2938155 0.71 BRD4 (0.40) BRD4LMNAALDH1A1RAB9ASMN1; SMN2

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
US-5780607-A PYRANOSYL NUCLEOSIDE MONOMER UNITS CONNECTED BY AMIDE LINKAGES HOFFMANN-LA ROCHE INC. (US) 1998-07-14 US claimed
WO-1997014709-A1 ANTISENSE OLIGOMERS F. HOFFMANN-LA ROCHE AG (CH) 1997-04-24 WO claimed
US-5780607-A PYRANOSYL NUCLEOSIDE MONOMER UNITS CONNECTED BY AMIDE LINKAGES HOFFMANN-LA ROCHE INC. (US) 1998-07-14 US disclosed
WO-1997014709-A1 ANTISENSE OLIGOMERS F. HOFFMANN-LA ROCHE AG (CH) 1997-04-24 WO disclosed
EP-0705264-A1 CARBO-ACYCLIC NUCLEOSIDE DERIVATIVES AS ANTIVIRAL AND ANTINEOPLASTIC AGENTS MERRELL PHARMACEUTICALS INC. (US) 1996-04-10 EP disclosed