SCHEMBL6835158

SCHEMBL6835158

O=C(O)N1CCN2C(=O)CC(=O)C2(Cc2ccccn2)C1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.40
KDM4E B2RXH2 6/20 0.40
MAPT P10636 2/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP46A1 Q9Y6A2 2/20 0.39
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
L3MBTL1 Q9Y468 2/20 0.37
HPGD P15428 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37
RECQL P46063 1/20 0.37
HSD17B10 Q99714 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36
DDB1 Q16531 1/20 0.36
CRBN Q96SW2 1/20 0.36
ALOX15 P16050 1/20 0.36
TDP1 Q9NUW8 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
SCHEMBL5224568 0.84 GPR119 (0.42) ALDH1A1KDM4EPOLB
SCHEMBL5228930 0.77 KDM4E (0.35) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL15353048 0.74 DDB1 (0.40) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL20137787 0.69 CYP46A1 (0.46) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL2930129 0.67 ALDH1A1 (0.72) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL23647559 0.66 CYP46A1 (0.44) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL8103240 0.64 GRIN2B (0.41) ALDH1A1KDM4ELMNAGAANPSR1
SCHEMBL30163900 0.64 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL9933469 0.64 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTTSHRMAPK1
SCHEMBL9933442 0.64 ALDH1A1 (0.49) ALDH1A1KDM4EMAPTTSHRMAPK1

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
US-RE38524-E1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2004-06-01 US disclosed
US-6251902-B1 Dipeptide derivatives as growth hormone secretagogues PFIZER INC. 2001-06-26 US disclosed