SCHEMBL8723154

SCHEMBL8723154

Cc1cnc2c(N)nc(=O)[nH]c2n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.42
GAA P10253 4/20 0.42
ALDH1A1 P00352 4/20 0.42
MAPT P10636 1/20 0.42
PKM P14618 1/20 0.42
KMT2A Q03164 1/20 0.42
GLA P06280 2/20 0.40
LMNA P02545 1/20 0.40
PMP22 Q01453 1/20 0.40
HSD17B10 Q99714 1/20 0.40
NPC1 O15118 1/20 0.35
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CCNB2 O95067 1/20 0.33
CDK1 P06493 1/20 0.33
CCNB1 P14635 1/20 0.33
CDK5 Q00535 1/20 0.33
CDK5R1 Q15078 1/20 0.33
CCNB3 Q8WWL7 1/20 0.33
MAPKAPK2 P49137 3/20 0.33

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
SCHEMBL3504133 0.86 PDK2 (0.38) KDM4EGAAALDH1A1MAPTPKM
SCHEMBL7682920 0.76 KDM4E (0.47) KDM4EGAAALDH1A1MAPTPKM
SCHEMBL529185 0.74 ADORA2A (0.39) KDM4EGAAALDH1A1MAPTPKM
SCHEMBL5309140 0.71 KDM4E (0.53) KDM4EGAAALDH1A1MAPTPKM
SCHEMBL8725028 0.68 P2RX3 (0.45) PKMKMT2ALMNANPC1SMN1; SMN2
SCHEMBL4406429 0.66 CDK5 (0.42) KDM4EGAAALDH1A1MAPTHSD17B10
SCHEMBL5481545 0.66 KDM4E (0.51) KDM4EGAAALDH1A1MAPTPKM
SCHEMBL7682917 0.66 AKR1B1 (0.60) KDM4EGAAALDH1A1MAPTKMT2A
SCHEMBL853172 0.66 ALDH1A1 (0.40) KDM4EGAAALDH1A1MAPTKMT2A
SCHEMBL21617557 0.64 DYRK1A (0.56) KDM4EGAAALDH1A1MAPTPKM

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-0759927-B1 PTERIDINE NUCLEOTIDE ANALOGS AS FLUORESCENT DNA PROBES US GOV HEALTH & HUMAN SERV (US) 1998-06-24 EP disclosed
US-5612468-A GENETIC ENGINEERING THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-03-18 US disclosed
EP-0759927-A1 PTERIDINE NUCLEOTIDE ANALOGS AS FLUORESCENT DNA PROBES THE GOVERNMENT OF THE UNITED STATES OF AMERICA as represented by the SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1997-03-05 EP disclosed
US-5525711-A MONOMERS FOR DNA AMPLIFICATION PROCEDURES THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1996-06-11 US disclosed
WO-1995031469-A1 PTERIDINE NUCLEOTIDE ANALOGS AS FLUORESCENT DNA PROBES THE GOVERNMENT OF THE UNITED STATES OF AMERICA, REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 1995-11-23 WO disclosed