SCHEMBL14608922

SCHEMBL14608922

CC(=O)N1C(C)CO[C@H]1c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.40
TSHR P16473 3/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NOTUM Q6P988 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
HTT P42858 1/20 0.37
CYP2C19 P33261 1/20 0.37
ALDH1A1 P00352 2/20 0.36
MAOB P27338 3/20 0.36
LMNA P02545 1/20 0.36
GLA P06280 1/20 0.36
HPGD P15428 1/20 0.36
HTR1A P08908 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
ELANE P08246 1/20 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
SCHEMBL6548647 0.80 POLB (0.41) POLBL3MBTL1TSHRMEN1KMT2A
SCHEMBL6442194 0.70 SLC18A3 (0.44) L3MBTL1TSHRALDH1A1HTR1A
SCHEMBL21393085 0.68 POLB (0.47) POLBL3MBTL1TSHRSMN1; SMN2NOTUM
SCHEMBL6444610 0.68 ALDH1A1 (0.40) TSHRALDH1A1HPGDHTR1A
SCHEMBL1324873 0.68 TSHR (0.44) POLBTSHRSMN1; SMN2HTTALDH1A1
SCHEMBL6442748 0.68 SLC18A3 (0.38) POLBL3MBTL1TSHRALDH1A1GLA
SCHEMBL14837450 0.68 TSHR (0.44) POLBTSHRSMN1; SMN2HTTALDH1A1
SCHEMBL30722427 0.68 CHRM2 (0.40) TSHRALDH1A1HPGDNPSR1
SCHEMBL12199520 0.66 SLC18A3 (0.43) POLBL3MBTL1TSHRMEN1KMT2A
SCHEMBL18436935 0.65 SMN1; SMN2 (0.47) POLBSMN1; SMN2NOTUMCYP2C19ALDH1A1

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
EP-0820283-B1 LACTACYSTIN ANALOGS HARVARD COLLEGE (US) 2007-02-14 EP disclosed