SCHEMBL7917839

SCHEMBL7917839

COc1ccc(OCCCC(N)=O)cc1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.61
HPGD P15428 3/20 0.58
L3MBTL1 Q9Y468 3/20 0.55
MTNR1A P48039 1/20 0.54
MTNR1B P49286 1/20 0.54
GAA P10253 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
PARP1 P09874 1/20 0.52
PARP10 Q53GL7 1/20 0.52
PARP2 Q9UGN5 1/20 0.52
PARP4 Q9UKK3 1/20 0.52
ATM Q13315 1/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
LMNA P02545 1/20 0.51
ALPL P05186 1/20 0.51
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL1117015 0.92 MAPT (0.66) MAPTHPGDL3MBTL1MTNR1AMTNR1B
SCHEMBL8029095 0.85 PDE4B (0.64) MAPTHPGDL3MBTL1MTNR1AMTNR1B
SCHEMBL6850906 0.85 L3MBTL1 (0.65) HPGDL3MBTL1PARP10ALDH1A1
SCHEMBL29800739 0.84 CHRM2 (0.57) MAPTHPGDMTNR1AMTNR1BGAA
Hydrochloric Acid SCHEMBL8981950 0.83 PDE4B (0.62) MAPTHPGDL3MBTL1MTNR1AMTNR1B
SCHEMBL8981940 0.83 MAPT (0.59) MAPTHPGDL3MBTL1MTNR1AMTNR1B
SCHEMBL7923893 0.82 LTA4H (0.53) L3MBTL1PARP10
SCHEMBL7928218 0.81 L3MBTL1 (0.76) MAPTHPGDL3MBTL1GAALMNA
SCHEMBL10533621 0.81 LMNA (0.58) MAPTHPGDL3MBTL1MTNR1AMTNR1B
SCHEMBL6851369 0.81 KMT2A (0.58) HPGDSMN1; SMN2LMNAALPLALDH1A1

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-2010039256-A1 2-ACYLAMINOPROPOANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITORS GENZYME CORPORATION (US) 2010-04-08 WO disclosed