SCHEMBL7804175

SCHEMBL7804175

O=C(O)C(COc1ccccc1)C1=CCN(C(=O)c2ccc3ccccc3c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.46
LMNA P02545 3/20 0.46
TSHR P16473 2/20 0.46
HPGD P15428 1/20 0.44
DRD4 P21917 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
POLB P06746 1/20 0.44
AKR1C1 Q04828 1/20 0.44
RAB9A P51151 2/20 0.43
ALDH1A1 P00352 3/20 0.41
HTT P42858 3/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CA7 P43166 1/20 0.41
CA9 Q16790 1/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL7810086 0.90 NPC1 (0.44) NPC1LMNATSHRHPGDDRD4
SCHEMBL7810158 0.89 KCNA5 (0.47) NPC1LMNAHPGDMEN1KMT2A
SCHEMBL7811215 0.86 NPC1 (0.42) NPC1HPGDMEN1KMT2ARAB9A
SCHEMBL7817583 0.85 NPC1 (0.44) NPC1LMNATSHRHPGDDRD4
SCHEMBL7810320 0.80 NPC1 (0.45) NPC1LMNATSHRHPGDDRD4
SCHEMBL7811731 0.78 NPC1 (0.43) NPC1LMNATSHRHPGDDRD4
SCHEMBL7817569 0.77 TSHR (0.56) NPC1LMNATSHRHPGDDRD4
SCHEMBL7814230 0.74 PTPN7 (0.49) NPC1LMNATSHRHPGDMEN1
SCHEMBL7814140 0.74 NPC1 (0.50) NPC1LMNATSHRHPGDDRD4
SCHEMBL7804403 0.74 DRD4 (0.56) NPC1LMNATSHRHPGDDRD4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0607536-B1 Arylamide derivatives SS PHARMACEUTICAL CO (JP) 2001-01-24 EP disclosed
US-5532371-A SIDE EFFECT REDUCTION SS PHARMACEUTICAL CO., LTD. (JP) 1996-07-02 US disclosed
US-5411972-A Arylamide derivatives for treating hyperlipemia SS PHARMACEUTICAL CO., LTD. (JP) 1995-05-02 US disclosed
EP-0607536-A1 Arylamide derivatives SS PHARMACEUTICAL CO., LTD. (JP) 1994-07-27 EP disclosed