SCHEMBL9706821

SCHEMBL9706821

CC(N)C(=O)Oc1ccccc1CC([NH])=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.38
CFD P00746 1/20 0.37
F11 P03951 1/20 0.37
TPSB2 P20231 1/20 0.37
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
GAA P10253 1/20 0.35
CXCL8 P10145 2/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35
ADRB2 P07550 1/20 0.34
ADRB1 P08588 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
ALOX15 P16050 1/20 0.34
MAPT P10636 1/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL8530900 0.83 HTT (0.37) L3MBTL1LMNASMN1; SMN2HPGDHTT
Hydrochloric Acid SCHEMBL29712425 0.83 L3MBTL1 (0.41) L3MBTL1SMN1; SMN2HPGDHTTMAPT
SCHEMBL10589984 0.81 ADRA2C (0.47) L3MBTL1LMNAADRB2ADRB1MEN1
SCHEMBL10970066 0.79 PTGS2 (0.49) L3MBTL1LMNAHPGDMAPTTSHR
SCHEMBL10782205 0.77 THRA (0.59) MEN1KMT2A
SCHEMBL4686006 0.75 GAA (0.55) LMNASMN1; SMN2GAAHPGDMAPT
SCHEMBL31112414 0.74 CXCL8 (0.53) L3MBTL1CFDF11TPSB2CXCL8
SCHEMBL1983875 0.74 TSHR (0.46) SMN1; SMN2GAAHPGDHTTIRAK4
SCHEMBL8399530 0.74 CA1 (0.45) L3MBTL1LMNASMN1; SMN2GAAHPGD
SCHEMBL5058437 0.74 TDP1 (0.46) L3MBTL1HPGDHTTADRB2ADRB1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0222022-B1 PROCESS FOR PRODUCING BETA-LACTAM DERIVATIVES Otsuka Kagaku Kabushiki Kaisha (JP) 1992-09-23 EP disclosed
US-5070194-A DEPROTECTION OF INTERMEDIATES OTSUKA KAGAKU KABUSHIKI KAISHA (JP) 1991-12-03 US disclosed
EP-0222022-A1 PROCESS FOR PRODUCING BETA-LACTAM DERIVATIVES Otsuka Kagaku Kabushiki Kaisha (JP) 1987-05-20 EP disclosed