SCHEMBL7874397

SCHEMBL7874397

CCOc1ccc(C(NC(=O)c2cccc(OC)c2)C(C)C(=O)O)cc1OCC

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.56
NPSR1 Q6W5P4 3/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
LMNA P02545 2/20 0.52
MAPT P10636 1/20 0.52
TAS1R3 Q7RTX0 1/20 0.50
TAS1R1 Q7RTX1 1/20 0.50
GPR139 Q6DWJ6 6/20 0.48
KMT2A Q03164 3/20 0.46
MEN1 O00255 2/20 0.46
POLB P06746 1/20 0.46
KCNB1 Q14721 1/20 0.45
TAAR1 Q96RJ0 1/20 0.44

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
SCHEMBL7874408 0.88 NPSR1 (0.62) ALDH1A1NPSR1SMN1; SMN2LMNAMAPT
SCHEMBL7867548 0.87 NPSR1 (0.51) ALDH1A1NPSR1SMN1; SMN2LMNAMAPT
SCHEMBL7867322 0.83 KMT2A (0.63) ALDH1A1NPSR1SMN1; SMN2LMNAMAPT
SCHEMBL7874393 0.81 NPSR1 (0.57) ALDH1A1NPSR1SMN1; SMN2LMNAMAPT
SCHEMBL7867583 0.80 NPSR1 (0.58) ALDH1A1NPSR1SMN1; SMN2LMNAMAPT
SCHEMBL7994381 0.76 NPSR1 (0.46) ALDH1A1NPSR1SMN1; SMN2LMNAMAPT
SCHEMBL24175859 0.73 TAS1R3 (0.68) ALDH1A1NPSR1SMN1; SMN2LMNATAS1R3
SCHEMBL21274338 0.73 TAS1R3 (0.61) ALDH1A1SMN1; SMN2LMNATAS1R3TAS1R1
SCHEMBL21274340 0.73 TAS1R3 (0.61) ALDH1A1SMN1; SMN2LMNATAS1R3TAS1R1
SCHEMBL7867528 0.72 KMT2A (0.62) ALDH1A1NPSR1SMN1; SMN2LMNAMAPT

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-0800505-B1 NOVEL IMMUNOTHERAPEUTIC ARYL AMIDES CELGENE CORP (US) 2001-09-26 EP claimed