SCHEMBL8720564

SCHEMBL8720564

CSc1nc(N)c(N)c(=O)n1C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.44
HPGD P15428 2/20 0.40
POLB P06746 1/20 0.40
ALDH1A1 P00352 9/20 0.39
KDM4E B2RXH2 4/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 4/20 0.36
TSHR P16473 1/20 0.36
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
CRHBP P24387 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
CRHR2 Q13324 1/20 0.35
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
CSNK2A1 P68400 1/20 0.35
MAPK1 P28482 1/20 0.33
CASP1 P29466 1/20 0.33
HSD17B10 Q99714 1/20 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
SCHEMBL301366 0.74 KDM4E (0.46) KDM4ETSHRMEN1KMT2A
SCHEMBL9300537 0.68 DPP4 (0.32) KDM4EMEN1KMT2A
SCHEMBL11679077 0.68 CSNK2A2 (0.35) ALDH1A1KDM4EKMT2ACSNK2A2CSNK2B
SCHEMBL9409123 0.67 SCN5A (0.51) RXFP1HPGDPOLBALDH1A1KDM4E
SCHEMBL10332494 0.67 ALDH1A1 (0.44) RXFP1HPGDPOLBALDH1A1KDM4E
SCHEMBL16007569 0.66 KDM4E (0.46) HPGDPOLBALDH1A1KDM4ELMNA
SCHEMBL11504223 0.65 CSNK2A2 (0.44) RXFP1HPGDPOLBALDH1A1KDM4E
SCHEMBL11504199 0.65 ALDH1A1 (0.43) RXFP1HPGDPOLBALDH1A1KDM4E
SCHEMBL3679657 0.63 ALDH1A1 (0.55) RXFP1HPGDPOLBALDH1A1KDM4E
SCHEMBL3686353 0.63 USP2 (0.64) POLBALDH1A1KDM4ELMNAMAPT

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