SCHEMBL6967680

SCHEMBL6967680

Cc1cccc(CN2CCc3c[c]ccc3C2C(N)=O)n1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.38
MEN1 O00255 4/20 0.38
KDM4E B2RXH2 4/20 0.36
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
LMNA P02545 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
PKM P14618 1/20 0.33
RIPK1 Q13546 1/20 0.32
EIF2AK3 Q9NZJ5 1/20 0.32

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
SCHEMBL6969655 0.89 FAAH (0.37)
SCHEMBL6975480 0.86
SCHEMBL6957978 0.83 SIRT1 (0.41) KMT2AKDM4EALDH1A1L3MBTL1SMN1; SMN2
SCHEMBL6965484 0.83 FAAH (0.39)
SCHEMBL6974425 0.80 GBA1 (0.39) KMT2AMEN1KDM4EALDH1A1PRMT5
SCHEMBL6970691 0.80 KDM4E (0.32) KDM4E
SCHEMBL6966047 0.79 ESR1 (0.37) KMT2AMEN1SMN1; SMN2
SCHEMBL6969704 0.79 MAPT (0.41) KMT2AMEN1ALDH1A1MAPTNPSR1
SCHEMBL6967724 0.78
SCHEMBL6976521 0.78 GRM2 (0.41) KMT2AMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0832069-B1 BIPHENYL-2-CARBOXYLIC ACID-TETRAHYDRO-ISOQUINOLIN-6-YL AMIDE DERIVATIVES, THEIR PREPARATION AND THEIR USE AS INHIBITORS OF MICROSOMAL TRIGLYCERIDE TRANSFER PROTEIN AND/OR APOLIPOPROTEIN B (Apo B) SECRETION PFIZER (US) 2003-03-05 EP disclosed
EP-1181954-A2 Biphenyl-2-carboxylic acid-tetrahydro-isoquinolin-6-yl amide derivatives, their preparation and use as inhibitors of microsomal triglyceride transfer protein and/or apolipoprotein B (ApoB) secretion PFIZER INC. (US) 2002-02-27 EP disclosed