SCHEMBL7013528

SCHEMBL7013528

CC(CC(=O)N1CCC[C@@H]1C(=O)N1CCCC1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PREP P48147 7/20 0.57
NPC1 O15118 1/20 0.55
ALDH1A1 P00352 1/20 0.55
HPGD P15428 1/20 0.55
TSHR P16473 1/20 0.55
RAB9A P51151 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL9501712 0.88 PREP (0.48) PREPNPC1ALDH1A1HPGDTSHR
SCHEMBL9501764 0.87 ACE (0.55) NPC1ALDH1A1HPGDTSHRRAB9A
SCHEMBL8696411 0.80 POLB (0.73) NPC1ALDH1A1HPGDTSHRRAB9A
SCHEMBL9500411 0.76 ALDH1A1 (0.50) NPC1ALDH1A1HPGDTSHRRAB9A
SCHEMBL5742878 0.75 CACNA1A (0.62) ALDH1A1SMN1; SMN2
SCHEMBL5742876 0.75 CACNA1A (0.62) ALDH1A1SMN1; SMN2
SCHEMBL6285958 0.74 PREP (0.65) PREPNPC1RAB9A
SCHEMBL6285952 0.74 PREP (0.65) PREPNPC1RAB9A
SCHEMBL9501243 0.74 KLK5 (0.49) NPC1ALDH1A1HPGDTSHRRAB9A
SCHEMBL28218046 0.73

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0861246-B1 PROLYL ENDOPEPTIDASE INHIBITORS, THEIR PREPARATION AND THEIR PHARMACEUTICAL USE SANDOR ERDOE DR (HU) 2003-10-15 EP disclosed
US-6191161-B1 NERVOUS SYSTEM DISORDERS CHINOIN GYOGYSZER ES VEGYESZETI (HU) 2001-02-20 US disclosed
EP-0861246-A1 PROLYLENDOPEPTIDASE INHIBITORS CHINOIN Gyogyszer és Vegyészeti Termékek Gyára RT. (HU) 1998-09-02 EP disclosed
WO-1998035960-A1 PROLYLENDOPEPTIDASE INHIBITORS Chinoin Gyógyszer és Vegyészeti Termékek Gyára Rt. (HU) 1998-08-20 WO disclosed
WO-1997007116-A1 PROLYLENDOPEPTIDASE INHIBITORS CHINOIN GYÓGYSZER ÉS VEGYÉSZETI (HU) 1997-02-27 WO disclosed
EP-0232849-B1 PYRROLIDINEAMIDE DERIVATIVE OF ACYLAMINO ACID, PHARMACEUTICAL COMPOSITION AND USE SUNTORY LIMITED (JP) 1993-05-05 EP disclosed
US-5198458-A Pyrrolidineamide derivatives of acylamino acid and pharmaceutical composition containing the same SUNTORY LIMITED (JP) 1993-03-30 US disclosed
US-4826870-A CURING AMNESIA SUNTORY LIMITED (JP) 1989-05-02 US disclosed