SCHEMBL11232608

SCHEMBL11232608

NC(=O)COC(=O)c1ccccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.58
KDM4E B2RXH2 6/20 0.55
ALDH1A1 P00352 3/20 0.55
GAA P10253 3/20 0.55
GLA P06280 1/20 0.55
HTT P42858 1/20 0.55
L3MBTL1 Q9Y468 4/20 0.51
HPGD P15428 3/20 0.51
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
PKM P14618 1/20 0.51
NFKB1 P19838 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
MAPT P10636 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL11228519 0.80 L3MBTL1 (0.52) SMN1; SMN2KDM4EALDH1A1GAAGLA
SCHEMBL11408488 0.80 TDP1 (0.62) SMN1; SMN2KDM4EALDH1A1GAAHTT
SCHEMBL10704503 0.79 CES2 (0.54) SMN1; SMN2ALDH1A1GAAHTTL3MBTL1
SCHEMBL2335100 0.79 NPC1 (0.54) SMN1; SMN2ALDH1A1GAAHTTL3MBTL1
SCHEMBL10905341 0.79 TSHR (0.52) SMN1; SMN2ALDH1A1GAAHTTL3MBTL1
SCHEMBL29112376 0.79 CYP1A2 (0.67) SMN1; SMN2ALDH1A1GAAHTTL3MBTL1
SCHEMBL4741221 0.79 ALDH1A1 (0.59) SMN1; SMN2KDM4EALDH1A1GAAHTT
SCHEMBL21953836 0.78 CES2 (0.52) SMN1; SMN2ALDH1A1GAAHTTL3MBTL1
SCHEMBL406428 0.78 TSHR (0.74) KDM4EALDH1A1HPGDMAPT
SCHEMBL6062063 0.76 HPGD (0.57) SMN1; SMN2ALDH1A1GAAGLAHTT

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
US-4309566-A RETARDATION OR STIMULATION OF GROWTH OF BROAD LEAF PLANTS FMC CORPORATION (US) 1982-01-05 US disclosed