SCHEMBL6161830

SCHEMBL6161830

NC(Cc1ccccc1)C(=O)N1CCC(O)CC1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRD1 P41143 2/20 0.65
HDAC8 Q9BY41 3/20 0.62
DPP4 P27487 4/20 0.58
POLB P06746 1/20 0.57
DPP8 Q6V1X1 2/20 0.55
DPP9 Q86TI2 2/20 0.55
DPP7 Q9UHL4 2/20 0.55
FAP Q12884 1/20 0.55
OPRK1 P41145 1/20 0.54
SMYD3 Q9H7B4 1/20 0.54
TACR1 P25103 1/20 0.53
PLAU P00749 1/20 0.52
PLAUR Q03405 1/20 0.52
AKT1 P31749 1/20 0.52
AKT2 P31751 1/20 0.52
AKT3 Q9Y243 1/20 0.52

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
SCHEMBL3133533 1.00 OPRD1 (0.65) OPRD1HDAC8DPP4POLBDPP8
Hydrochloric Acid SCHEMBL6165745 0.99 HDAC8 (0.63) OPRD1HDAC8DPP4POLBDPP8
Hydrochloric Acid SCHEMBL6163301 0.99 HDAC8 (0.63) OPRD1HDAC8DPP4POLBDPP8
Hydrochloric Acid SCHEMBL6163295 0.99 HDAC8 (0.63) OPRD1HDAC8DPP4POLBDPP8
SCHEMBL4086820 0.92 HDAC8 (0.59) OPRD1HDAC8DPP4POLBDPP8
SCHEMBL4095232 0.92 HDAC8 (0.59) OPRD1HDAC8DPP4POLBDPP8
SCHEMBL6052747 0.92 HDAC8 (0.59) OPRD1HDAC8DPP4POLBDPP8
SCHEMBL7371920 0.88 NPC1 (0.58) OPRD1HDAC8DPP4DPP8DPP9
SCHEMBL7360693 0.87 HPGD (0.66) OPRD1HDAC8DPP4POLBDPP8
SCHEMBL2375481 0.86 OPRK1 (0.71) OPRD1HDAC8DPP4POLBOPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1134213-B1 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER (US) 2005-11-02 EP disclosed
EP-0832065-B1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER (US) 2001-10-10 EP disclosed
EP-1134213-A2 Process for the preparation of substituted N-(indole-2-carbonyl)- glycinamides PFIZER INC. (US) 2001-09-19 EP disclosed
US-6277877-B1 GLYCOGEN PHOSPHORYLASE INHIBITOR; ANTIDIABETIC AGENTS PFIZER, INC. 2001-08-21 US disclosed
US-6107329-A HYPOTENSIVE AGENTS; CARDIOVASCULAR DISORDERS PFIZER, INC. (US) 2000-08-22 US disclosed
EP-0832065-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER INC. (US) 1998-04-01 EP disclosed
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed