SCHEMBL6163528

SCHEMBL6163528

Cc1ccc(S(=O)(=O)n2cnc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N3CCC(O)CC3)c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 1/20 0.56
TLR2 O60603 1/20 0.49
TLR1 Q15399 1/20 0.49
KMT2A Q03164 6/20 0.44
MEN1 O00255 4/20 0.44
P2RX7 Q99572 2/20 0.42
MAPK1 P28482 1/20 0.40
HRH2 P25021 1/20 0.38
HRH1 P35367 1/20 0.38
PABPC1 P11940 1/20 0.38
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
MMP13 P45452 1/20 0.37
TSHR P16473 1/20 0.36
POLB P06746 1/20 0.36

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
SCHEMBL29401167 0.84 KLK7 (0.61) KLK7TLR2TLR1KMT2AMEN1
SCHEMBL3912355 0.84 KLK7 (0.61) KLK7TLR2TLR1KMT2AMEN1
SCHEMBL29398857 0.79 KLK7 (0.53) KLK7TLR2TLR1KMT2AMEN1
SCHEMBL9354561 0.79 KLK7 (0.56) KLK7TLR2TLR1KMT2AP2RX7
SCHEMBL9354881 0.78 KLK7 (0.60) KLK7TLR2TLR1P2RX7
SCHEMBL7441367 0.77 KLK7 (0.53) KLK7TLR2TLR1KMT2AMEN1
SCHEMBL9354935 0.76 KLK7 (0.57) KLK7TLR2TLR1P2RX7
SCHEMBL5709602 0.75 KLK7 (0.51) KLK7TLR2TLR1KMT2AMEN1
SCHEMBL9025557 0.74 KLK7 (0.58) KLK7TLR2TLR1
SCHEMBL5891788 0.73 KMT2A (0.45) KMT2AMEN1MAPK1HRH2HRH1

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