SCHEMBL6163349

SCHEMBL6163349

NC(=O)C1CC(=O)CCN1C(=O)[CH]Cc1ccccc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.34
CYP2C19 P33261 2/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 1/20 0.34
SPHK1 Q9NYA1 2/20 0.34
SPHK2 Q9NRA0 1/20 0.34
POLB P06746 1/20 0.33
HTR1A P08908 4/20 0.33
HTR7 P34969 4/20 0.33
HTR2A P28223 1/20 0.33
HTR6 P50406 1/20 0.33
F2 P00734 1/20 0.33
TACR1 P25103 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
GAA P10253 1/20 0.33

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
SCHEMBL3138570 0.81 SPHK1 (0.50) SPHK1SPHK2HTR1AHTR7F2
SCHEMBL6163684 0.80 SMN1; SMN2 (0.35) PKMCYP2C19SMN1; SMN2ALDH1A1TACR1
SCHEMBL6163270 0.80 SPHK1 (0.47) ALDH1A1SPHK1SPHK2HTR1AHTR7
SCHEMBL3133531 0.78 DPP4 (0.38) CYP2C19SMN1; SMN2ALDH1A1SPHK1SPHK2
SCHEMBL3137610 0.78 CNR2 (0.39) CYP2C19SMN1; SMN2SPHK1SPHK2TACR1
SCHEMBL6164608 0.78 CA1 (0.42) CYP2C19KMT2ASMN1; SMN2HTR6
SCHEMBL6052943 0.78 MAOB (0.40) CYP2C19KMT2ASMN1; SMN2ALDH1A1CYP3A4
SCHEMBL6164063 0.74 ACE (0.47) ALDH1A1
SCHEMBL7361665 0.74 GAA (0.36) CYP2C19SMN1; SMN2SPHK1SPHK2TACR1
SCHEMBL6160667 0.74 TACR1 (0.42) PKMALDH1A1POLBTACR1GAA

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