SCHEMBL7071341

SCHEMBL7071341

CCc1c(Sc2ccccc2)n(CC2=CCC(CO)C2)c(=O)[nH]c1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 1/20 0.32
ALDH1A1 P00352 2/20 0.32
BRD4 O60885 3/20 0.31
BRDT Q58F21 2/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL7071340 0.87
SCHEMBL7070306 0.86 POLB (0.33) MEN1KMT2A
SCHEMBL7071722 0.82 GAA (0.32) MEN1KMT2AGAAALDH1A1BRD4
SCHEMBL7071625 0.79 ALDH1A1 (0.40) MEN1KMT2AGAAALDH1A1TSHR
SCHEMBL7071591 0.78 GAA (0.32) MEN1KMT2AGAAALDH1A1BRD4
SCHEMBL7067905 0.78 GAA (0.32) MEN1KMT2AGAAALDH1A1BRD4
SCHEMBL7067908 0.77 MEN1 (0.32) MEN1KMT2AGAAALDH1A1BRD4
SCHEMBL7067258 0.77 ALDH1A1 (0.35) MEN1KMT2AGAAALDH1A1BRD4
SCHEMBL7070966 0.74
SCHEMBL7066669 0.73 BRD4 (0.34) MEN1KMT2AGAAALDH1A1BRD4

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-0827498-B1 NEW ANTIVIRAL SUBSTITUTED PYRIMIDINEDIONE HOMOCARBOCYCLIC NUCLEOSIDE DERIVATIVES AND METHODS FOR THE PREPARATION THEREOF AND COMPOSITIONS CONTAINING THE SAME AS ACTIVE INGREDIENTS SAMJIN PHARM CO LTD (KR) 2003-06-18 EP disclosed
US-5922727-A 1-((SUBSTITUTED)CYCLOALK(EN)YLALKYL)-6-((SUB)PHENYL(CARBONYL, SULFIDE, OR OXO))-2,4-PYRIMIDINEDIONE DERIVATIVES HAVING SUPERIOR ANTIVIRAL ACTIVITIES; HIV SAMJIN PHARMACEUTICAL CO., LTD (KR) 1999-07-13 US disclosed