SCHEMBL6535540

SCHEMBL6535540

CC1CN(C(=O)Cc2ccccc2)C1=O

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.54
GLA P06280 1/20 0.54
HPGD P15428 1/20 0.54
TSHR P16473 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
TACR3 P29371 1/20 0.47
POLB P06746 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
HSD11B1 P28845 1/20 0.46
FAAH O00519 4/20 0.46
NAAA Q02083 2/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 2/20 0.43
CES2 O00748 1/20 0.42
CES1 P23141 1/20 0.42

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
SCHEMBL7382237 0.78 MAPT (0.52) MEN1KMT2AKDM4E
SCHEMBL16721552 0.75 BRD4 (0.64) ALDH1A1GLAHPGDSMN1; SMN2
SCHEMBL6439934 0.74 ALDH1A1 (0.47) ALDH1A1GLAHPGDTACR3POLB
SCHEMBL6535800 0.72 ALDH1A1 (0.64) ALDH1A1TSHRSMN1; SMN2TACR3POLB
SCHEMBL7050115 0.72 TSHR (0.57) ALDH1A1GLAHPGDTSHRSMN1; SMN2
SCHEMBL6535855 0.72 ALDH1A1 (0.48) ALDH1A1GLAHPGDTSHRL3MBTL1
SCHEMBL12385822 0.71 ALDH1A1 (0.67) ALDH1A1GLAHPGDTSHRSMN1; SMN2
SCHEMBL4113820 0.71 ALDH1A1 (0.68) ALDH1A1GLAHPGDTSHRSMN1; SMN2
SCHEMBL14197774 0.71 ALDH1A1 (0.67) ALDH1A1GLAHPGDTSHRSMN1; SMN2
SCHEMBL8060133 0.70 L3MBTL1 (0.58) ALDH1A1GLAHPGDTSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1318806-A4 FATTY ACID SYNTHASE INHIBITORS SMITHKLINE BEECHAM CORP (US) 2004-01-21 EP disclosed
EP-1318806-A1 FATTY ACID SYNTHASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2003-06-18 EP disclosed
WO-2002024197-A1 FATTY ACID SYNTHASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2002-03-28 WO disclosed