SCHEMBL5199090

SCHEMBL5199090

CCc1c(Cc2cc(C)cc(C)c2)n(COCCCCN(OC(=O)Oc2ccccc2)C(=O)Oc2ccccc2)c(=O)[nH]c1=O

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
UPP1 Q16831 1/20 0.32
ALDH1A1 P00352 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
HPGD P15428 1/20 0.30
LMNA P02545 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL5199377 0.90 UPP1 (0.38) UPP1ALDH1A1L3MBTL1HPGD
SCHEMBL5200738 0.86 ALDH1A1 (0.31) UPP1ALDH1A1L3MBTL1TDP1
SCHEMBL6302823 0.82 UPP1 (0.34) UPP1ALDH1A1
SCHEMBL5198809 0.80 TDP1 (0.39) UPP1ALDH1A1LMNATDP1
SCHEMBL5199124 0.78 UPP1 (0.37) UPP1
SCHEMBL5198534 0.77 UPP1 (0.38) UPP1ALDH1A1TDP1
SCHEMBL6309399 0.76 KMT2A (0.36) ALDH1A1TDP1
SCHEMBL5197713 0.75 MEN1 (0.32) UPP1ALDH1A1TDP1
SCHEMBL5200101 0.75 SMN1; SMN2 (0.34) UPP1ALDH1A1TDP1
SCHEMBL5199239 0.75 UPP1 (0.44) UPP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1355887-B1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES, PREPARATION METHOD AND USE THEREOF UNIV GENEVE (CH) 2007-08-15 EP disclosed
US-6911450-B1 Pyrimidine acyclonucleoside derivatives, preparation method and use thereof UNIVERSITE DE GENEVE (CH) 2005-06-28 US disclosed