SCHEMBL6166781

SCHEMBL6166781

CC1(C)CC(NC(=O)[CH]Cc2ccccc2)CC(C)(C(N)=O)N1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.48
HTT P42858 1/20 0.46
KMT2A Q03164 3/20 0.45
KDM4E B2RXH2 1/20 0.45
POLB P06746 2/20 0.44
EZH2 Q15910 6/20 0.44
TSHR P16473 1/20 0.41
USP2 O75604 1/20 0.40
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL630659 0.84 TSHR (0.43) GAAHTTKMT2APOLBEZH2
SCHEMBL631683 0.82 MEN1 (0.45) HTTKMT2APOLBEZH2TSHR
SCHEMBL5170755 0.74 TSHR (0.54) GAAHTTKMT2APOLBEZH2
SCHEMBL7977721 0.72 POLB (0.45) GAAHTTKMT2AKDM4EPOLB
SCHEMBL2687705 0.69 EPHX2 (0.62) KMT2ATSHRMEN1
SCHEMBL19712313 0.69 EPHX2 (0.40) TSHRMAPT
SCHEMBL19712342 0.68 HSD17B10 (0.44) GAAPOLBTSHR
SCHEMBL17067309 0.68 POLB (0.59) GAAHTTKMT2AKDM4EPOLB
SCHEMBL6166782 0.68 POLB (0.62) GAAHTTKMT2AKDM4EPOLB
SCHEMBL19712315 0.67 EPHX2 (0.38) TSHRMAPT

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-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
WO-1996039384-A1 SUBSTITUTED N-(INDOLE-2-CARBONYL)-GLYCINAMIDES AND DERIVATIVES AS GLYCOGEN PHOSPHORYLASE INHIBITORS PFIZER, INC. (US) 1996-12-12 WO disclosed