SCHEMBL10794874

SCHEMBL10794874

CCCC(=NOC(=O)COc1ccc(Cl)cc1)P(=O)(OCC)OCC

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.52
L3MBTL1 Q9Y468 4/20 0.48
TDP1 Q9NUW8 4/20 0.48
MAPT P10636 3/20 0.48
NPSR1 Q6W5P4 1/20 0.48
GLA P06280 1/20 0.44
KMT2A Q03164 3/20 0.42
ALDH1A1 P00352 2/20 0.42
MEN1 O00255 1/20 0.42
PTGS2 P35354 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C19 P33261 1/20 0.41
GAA P10253 1/20 0.41
BLM P54132 1/20 0.40
PMP22 Q01453 1/20 0.40
POLB P06746 1/20 0.39

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
SCHEMBL10795577 0.92 SMN1; SMN2 (0.49) SMN1; SMN2L3MBTL1TDP1MAPTNPSR1
SCHEMBL10824092 0.87 SMN1; SMN2 (0.55) SMN1; SMN2L3MBTL1TDP1MAPTNPSR1
SCHEMBL10795787 0.84 SMN1; SMN2 (0.55) SMN1; SMN2L3MBTL1TDP1MAPTNPSR1
SCHEMBL10613317 0.83 SMN1; SMN2 (0.61) SMN1; SMN2L3MBTL1TDP1MAPTNPSR1
SCHEMBL10795801 0.81 L3MBTL1 (0.57) SMN1; SMN2L3MBTL1TDP1MAPTNPSR1
SCHEMBL10799238 0.80 KMT2A (0.44) SMN1; SMN2L3MBTL1TDP1MAPTKMT2A
SCHEMBL10613284 0.80 L3MBTL1 (0.57) SMN1; SMN2L3MBTL1TDP1MAPTNPSR1
SCHEMBL10794878 0.79 SMN1; SMN2 (0.47) SMN1; SMN2L3MBTL1TDP1MAPTNPSR1
SCHEMBL10824085 0.79 SMN1; SMN2 (0.52) SMN1; SMN2L3MBTL1TDP1MAPTNPSR1
SCHEMBL10795592 0.74 KMT2A (0.57) SMN1; SMN2L3MBTL1TDP1MAPTGLA

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-4652666-A PLANT SAFENING AGENTS HOECHST AKTIENGESELLSCHAFT (DE) 1987-03-24 US disclosed