SCHEMBL9073271

SCHEMBL9073271

CSc1ccc(C(=O)CC(=O)C2CC2)c(C)c1Cl

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HPGD P15428 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
GAA P10253 1/20 0.33
SLC6A4 P31645 5/20 0.32
SLC6A2 P23975 4/20 0.32
THRB P10828 2/20 0.32
HSD17B10 Q99714 2/20 0.32
HTR7 P34969 2/20 0.31
P2RX7 Q99572 1/20 0.30
SLC6A3 Q01959 1/20 0.30
ERCC5 P28715 1/20 0.30
FEN1 P39748 1/20 0.30
KDM4E B2RXH2 1/20 0.30
LMNA P02545 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL8813179 0.83 SLC6A4 (0.45) MEN1KMT2ASLC6A4SLC6A2P2RX7
SCHEMBL9069942 0.82 DRD2 (0.39) MAPTSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL6748543 0.80 ERCC5 (0.39) MAPTSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL8494921 0.78 SMN1; SMN2 (0.35) MAPTSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL7550426 0.77 ALDH1A1 (0.33) MAPTALDH1A1KMT2AGAALMNA
SCHEMBL6746643 0.77 ERCC5 (0.36) MAPTSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL8389663 0.75 SMN1; SMN2 (0.36) MAPTSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL7574482 0.73 HPGD (0.33) SMN1; SMN2ALDH1A1HPGDKMT2AP2RX7
SCHEMBL3773890 0.73 TSHR (0.37) MAPTSMN1; SMN2ALDH1A1HPGDMEN1
SCHEMBL30978700 0.73 TSHR (0.37) MAPTSMN1; SMN2ALDH1A1HPGDMEN1

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-0527037-B1 4-Benzoylisoxazole derivatives and their use as herbicides RHONE POULENC AGRICULTURE (GB) 1996-10-16 EP disclosed
EP-0527037-A1 4-Benzoylisoxazole derivatives and their use as herbicides RHONE-POULENC AGRICULTURE LTD. (GB) 1993-02-10 EP disclosed