SCHEMBL8890556

SCHEMBL8890556

CSc1ccc(Cc2ccccc2C(=O)c2cnoc2C2CC2)c(Cl)c1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
ALDH1A1 P00352 5/20 0.32
CASP3 P42574 1/20 0.32
RAB9A P51151 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
SENP8 Q96LD8 1/20 0.32
SENP7 Q9BQF6 1/20 0.32
SENP6 Q9GZR1 1/20 0.32
KDM4E B2RXH2 3/20 0.32
NR1H4 Q96RI1 1/20 0.31
HSD17B10 Q99714 3/20 0.31
KMT2A Q03164 3/20 0.31
MAPT P10636 1/20 0.31
TAS1R3 Q7RTX0 1/20 0.31
TAS1R1 Q7RTX1 1/20 0.31
TAS1R2 Q8TE23 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
SCHEMBL8889854 0.90 SMN1; SMN2 (0.34) HPGDSMN1; SMN2ALDH1A1CASP3RAB9A
SCHEMBL8891270 0.89 TAS1R3 (0.33) HPGDSMN1; SMN2ALDH1A1CASP3RAB9A
SCHEMBL8890370 0.89 HPGD (0.34) HPGDSMN1; SMN2ALDH1A1CASP3RAB9A
SCHEMBL8890896 0.87 TBXA2R (0.41) HPGDSLC6A2SLC6A4SLC6A3ALDH1A1
SCHEMBL8889963 0.85 SLC6A2 (0.34) HPGDSMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL8891512 0.84 HPGD (0.36) HPGDSMN1; SMN2ALDH1A1CASP3RAB9A
SCHEMBL8892594 0.84 MAPT (0.35) ALDH1A1NPSR1KMT2AMAPTTAS1R3
SCHEMBL8889996 0.83 SLC6A2 (0.32) SLC6A2SLC6A4SLC6A3NR1H4TAS1R3
SCHEMBL8890050 0.83 NR1H4 (0.34) HPGDSMN1; SMN2SLC6A2SLC6A4SLC6A3
SCHEMBL8889920 0.83 EPHX2 (0.36) ALDH1A1NR1H4KMT2AMAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1997028136-A1 BENZOYLISOXAZOLES AND 2-CYANO-1,3-DIONE DERIVATIVES AND THEIR USE AS HERBICIDES RHONE-POULENC AGRICULTURE LTD. (GB) 1997-08-07 WO disclosed