SCHEMBL4616653

SCHEMBL4616653

c1cnc(C2OCCO2)nc1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NSD2 O96028 1/20 0.36
CASP6 P55212 1/20 0.36
MAPK1 P28482 1/20 0.34
CCNB2 O95067 1/20 0.32
CDK1 P06493 1/20 0.32
CCNB1 P14635 1/20 0.32
GSK3B P49841 1/20 0.32
CDK5 Q00535 1/20 0.32
CDK5R1 Q15078 1/20 0.32
CCNB3 Q8WWL7 1/20 0.32

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
SCHEMBL10632381 0.90 POLB (0.34) NSD2CASP6MAPK1
SCHEMBL9854901 0.72 MAPK1 (0.38) MAPK1
Fluoride SCHEMBL28071051 0.72 MAPK1 (0.38) MAPK1
SCHEMBL6982003 0.72 ALDH1A1 (0.42) MAPK1
SCHEMBL10375163 0.70
SCHEMBL7784164 0.70 MAPK1 (0.33) MAPK1
SCHEMBL17796068 0.68 NSD2 (0.36) NSD2CASP6
SCHEMBL9542666 0.68 NPC1 (0.39)
Iodomethane SCHEMBL11687901 0.68 ALDH1A1 (0.39) MAPK1
SCHEMBL30749231 0.68 TRIM24 (0.37) NSD2CASP6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239891-A Method for preparing N- (5-pyrimidine methyl) -2-pyridine amine compound 帕潘纳(北京)科技有限公司 2024-06-25 CN disclosed
EP-1893585-A1 PROCESS FOR THE PREPARATION OF N-[4-(4-FLUOROPHENYL)-5-FORMYL-6-ISOPROPYL-PYRIMIDIN-2-YL]-N-METHYLMETHANESULFONAMIDE Fermion Oy (FI) 2008-03-05 EP disclosed
WO-2006128954-A1 PROCESS FOR THE PREPARATION OF N-[4-(4-FLUOROPHENYL)-5-FORMYL-6-ISOPROPYL-PYRIMIDIN-2-YL]-N-METHYLMETHANESULFONAMIDE FERMION OY (FI) 2006-12-07 WO disclosed
EP-0956021-B1 L-BETA-DIOXOLANE URIDINE ANALOGS FOR TREATING AND PREVENTING INFECTIONS BY EBV, VZV AND HV-8 UNIV YALE (US) 2004-11-03 EP disclosed
US-6274589-B1 VIRICIDES TO TREAT EPSTEIN-BARR, VARICELLA-ZOSTER, AND/OR HERPES INFECTIONS; KAPOSI'S SARCOMA YALE UNIVERSITY 2001-08-14 US disclosed
US-6022876-A KAPOSI'S SARCOMA; VARICELLA-ZOSTER VIRUS YALE UNIVERSITY (US) 2000-02-08 US disclosed
EP-0956021-A1 L-$g(b)-DIOXOLANE URIDINE ANALOGS AND METHODS FOR TREATING AND PREVENTING VIRUS INFECTIONS YALE UNIVERSITY (US) 1999-11-17 EP disclosed
US-5792773-A L-β-dioxolane uridine analog administration for treating Epstein-Barr virus infection YALE UNIVERSITY (US) 1998-08-11 US disclosed
WO-1998020879-A1 L-β-DIOXOLANE URIDINE ANALOGS AND METHODS FOR TREATING AND PREVENTING VIRUS INFECTIONS YALE UNIVERSITY (US) 1998-05-22 WO disclosed