SCHEMBL7804396

SCHEMBL7804396

O=C(O)C(CCOc1ccccc1)C1CCN(C(=O)c2ccc3ccccc3c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.54
RAB9A P51151 1/20 0.54
DRD4 P21917 3/20 0.52
TSHR P16473 2/20 0.48
LMNA P02545 1/20 0.48
HPGD P15428 2/20 0.47
AKR1C1 Q04828 1/20 0.46
HRH3 Q9Y5N1 2/20 0.46
CAPN1 P07384 1/20 0.46
CTSB P07858 1/20 0.46
AVPR1A P37288 1/20 0.45
AVPR1B P47901 1/20 0.45
KCNA5 P22460 1/20 0.45
MEN1 O00255 1/20 0.44
POLB P06746 1/20 0.44
KMT2A Q03164 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
SCHEMBL7804403 0.89 DRD4 (0.56) NPC1RAB9ADRD4TSHRLMNA
SCHEMBL9011157 0.85 DRD4 (0.63) NPC1RAB9ADRD4TSHRLMNA
SCHEMBL9010973 0.83 DRD4 (0.63) NPC1RAB9ADRD4TSHRLMNA
SCHEMBL7814366 0.82 MEN1 (0.50) TSHRLMNAAVPR1AMEN1POLB
SCHEMBL7811430 0.81 TSHR (0.54) NPC1RAB9ADRD4TSHRLMNA
SCHEMBL7811589 0.80 DRD4 (0.55) NPC1RAB9ADRD4TSHRLMNA
SCHEMBL7804412 0.79 NPC1 (0.48) NPC1RAB9ADRD4TSHRLMNA
SCHEMBL7804380 0.77 KCNA5 (0.52) NPC1LMNAHPGDKCNA5MEN1
SCHEMBL7817804 0.77 NPC1 (0.54) NPC1RAB9ADRD4TSHRLMNA
SCHEMBL7811611 0.76 NPC1 (0.56) NPC1RAB9ADRD4TSHRLMNA

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