SCHEMBL28772121

SCHEMBL28772121

Cc1nc(C2CCN(C(=O)O)CC2)sc1CCl

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.38
UBE2M P61081 7/20 0.38
DCUN1D1 Q96GG9 7/20 0.38
LMNA P02545 6/20 0.36
MAPT P10636 6/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
RECQL P46063 1/20 0.36
HTT P42858 4/20 0.36
ALDH1A1 P00352 3/20 0.36
GAA P10253 3/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TP53 P04637 4/20 0.36
POLB P06746 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35

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
SCHEMBL3528682 0.76 ALDH1A1 (0.36) MEN1KMT2ACYP3A4ALDH1A1HSD17B10
SCHEMBL1118089 0.71 SLC6A3 (0.40) KMT2ASMN1; SMN2
SCHEMBL1118433 0.71 KDM4E (0.46) L3MBTL1MAPTHTTALDH1A1GAA
SCHEMBL17766776 0.69 SCN9A (0.50) UBE2MDCUN1D1LMNAMAPTMEN1
SCHEMBL17541543 0.69 HSD11B1 (0.47) ALDH1A1
SCHEMBL6122552 0.67 UBE2M (0.30) UBE2MDCUN1D1
SCHEMBL27028373 0.65 SMN1; SMN2 (0.38) UBE2MDCUN1D1LMNAMEN1KMT2A
Hydrochloric Acid SCHEMBL20378314 0.65 PIK3CD (0.43) L3MBTL1UBE2MDCUN1D1LMNAKMT2A
SCHEMBL1884146 0.64 CASP3 (0.48) L3MBTL1MAPTMEN1KMT2ACYP1A2
SCHEMBL21381077 0.64 HCRTR2 (0.48) L3MBTL1LMNAMAPTMEN1KMT2A

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
CN-101272784-A Phenyl- and pyridinyl- 1, 2 , 4 - oxadiazolone derivatives, processes for their preparation and their use as pharmaceuticals SANOFI AVENTIS (FR) 2008-09-24 CN disclosed