SCHEMBL9765177

SCHEMBL9765177

CC(C)OC(=O)CCSC(=O)c1cc(N2C(=O)C3=C(CCCC3)C2=O)ccc1Cl

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
ALDH1A1 P00352 2/20 0.35
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
HTT P42858 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
PPOX P50336 1/20 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
SCHEMBL9765169 0.90 SLC6A2 (0.37) SLC6A2SLC6A3ALDH1A1MAPTSMN1; SMN2
SCHEMBL9765212 0.89 MEN1 (0.39) SLC6A2SLC6A3ALDH1A1MAPTHSD17B10
SCHEMBL9765536 0.87 KMT2A (0.37) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9765223 0.81 MEN1 (0.40) SLC6A2SLC6A3ALDH1A1MAPTHSD17B10
SCHEMBL9765210 0.79 KMT2A (0.38) ALDH1A1MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL9765218 0.77 KMT2A (0.38) ALDH1A1MAPTMEN1KMT2ALMNA
SCHEMBL9765167 0.77 MEN1 (0.35) ALDH1A1MAPTHSD17B10MEN1KMT2A
SCHEMBL9765180 0.76 ALDH1A1 (0.35) ALDH1A1MAPTSMN1; SMN2ALOX15MEN1
SCHEMBL9765187 0.74 SLC6A3 (0.41) SLC6A3ALDH1A1MAPTSMN1; SMN2MEN1
SCHEMBL11060009 0.73 MEN1 (0.58) SLC6A2SLC6A3ALDH1A1MAPTSMN1; SMN2

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-0233151-B1 ESTERS AS HERBICIDES CIBA-GEIGY AG (CH) 1991-11-13 EP claimed
US-5034048-A Plant growth regulators, 5(tetrahydrophthalamido)benzoic acid derivatives for controlling weeds CIBA-GEIGY CORPORATION (US) 1991-07-23 US disclosed