SCHEMBL7534136

SCHEMBL7534136

CCOCn1c(Cl)c(CC)c(=O)[nH]c1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.44
ALDH1A1 P00352 2/20 0.34
POLB P06746 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 2/20 0.32
DRD1 P21728 2/20 0.32
MEN1 O00255 3/20 0.32
KMT2A Q03164 3/20 0.32
CYP1A2 P05177 2/20 0.32
TDP1 Q9NUW8 1/20 0.32
CYP2C19 P33261 1/20 0.32
TSHR P16473 2/20 0.31
LMNA P02545 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2D6 P10635 1/20 0.31
NFKB1 P19838 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
GLA P06280 1/20 0.31
TYMP P19971 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
SCHEMBL598947 0.73 ALDH1A1 (0.45) SMN1; SMN2ALDH1A1HPGDMEN1KMT2A
SCHEMBL8073685 0.72 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1HPGDDRD1MEN1
SCHEMBL9885874 0.71 ALDH1A1 (0.34) SMN1; SMN2ALDH1A1POLBMAPTHPGD
SCHEMBL8069213 0.71 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1POLBMAPTHPGD
SCHEMBL7037489 0.71 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1MAPTHPGDDRD1
SCHEMBL2107018 0.71 SMN1; SMN2 (0.36) SMN1; SMN2ALDH1A1HPGDMEN1KMT2A
SCHEMBL599846 0.71 ALDH1A1 (0.41) SMN1; SMN2ALDH1A1HPGDMEN1KMT2A
SCHEMBL1443402 0.71 ALDH1A1 (0.43) SMN1; SMN2ALDH1A1POLBHPGDMEN1
SCHEMBL7031964 0.70 KMT2A (0.39) SMN1; SMN2ALDH1A1MAPTHPGDMEN1
SCHEMBL1484512 0.70 SMN1; SMN2 (0.35) SMN1; SMN2ALDH1A1POLBMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0748316-B1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES SUNKYONG IND LTD (KR) 2002-05-08 EP disclosed
US-5889013-A REACTING AN URACIL COMPOUND WITH N, O-BIS/TRIMETHYLSILYL/ACETAMIDE FOLLOWED BY TETRABUTYLAMMONIUM IODIDE AND CHLOROMETHYL ETHER COMPOUND AND THEN REACTING WITH ARYL SELENOL IN A BASE SUNKYONG INDUSTRIES CO., INC. (KR) 1999-03-30 US disclosed
EP-0748316-A1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES SUNKYONG INDUSTRIES CO., LTD. (KR) 1996-12-18 EP disclosed
WO-1995023138-A1 PYRIMIDINE ACYCLONUCLEOSIDE DERIVATIVES SUNKYONG INDUSTRIES CO., LTD. (KR) 1995-08-31 WO disclosed