SCHEMBL8889692

SCHEMBL8889692

CSc1ccccc1Cc1cc(C)ccc1C(=O)c1cnoc1C1CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HPGD P15428 4/20 0.36
CASP3 P42574 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
MAPT P10636 4/20 0.35
PKM P14618 1/20 0.35
LMNA P02545 1/20 0.33
TAS1R3 Q7RTX0 1/20 0.33
TAS1R1 Q7RTX1 1/20 0.33
TAS1R2 Q8TE23 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
GAA P10253 1/20 0.32
SLC6A2 P23975 2/20 0.32

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
SCHEMBL8891465 0.91 HPGD (0.39) ALDH1A1MEN1KMT2AHPGDCASP3
SCHEMBL8889689 0.90 HPGD (0.39) ALDH1A1MEN1KMT2AHPGDCASP3
SCHEMBL8907895 0.89 HPGD (0.36) ALDH1A1MEN1KMT2AHPGDCASP3
SCHEMBL8900763 0.89 HPGD (0.38) ALDH1A1MEN1KMT2AHPGDCASP3
SCHEMBL8892156 0.89 HPGD (0.36) ALDH1A1MEN1KMT2AHPGDCASP3
SCHEMBL8891934 0.87 DHODH (0.41) ALDH1A1MEN1KMT2AHPGDCASP3
SCHEMBL8891649 0.86 SLC6A2 (0.37) ALDH1A1MEN1KMT2ANPSR1SLC6A2
SCHEMBL8890525 0.85 HPGD (0.39) ALDH1A1MEN1KMT2AHPGDCASP3
SCHEMBL8890047 0.84 HPGD (0.39) ALDH1A1MEN1KMT2AHPGDCASP3
SCHEMBL8891163 0.84 PDE2A (0.33) MEN1KMT2ATAS1R3TAS1R1TAS1R2

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