SCHEMBL6508980

SCHEMBL6508980

NC(=O)CC(c1ccccc1)C1CCCNC1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
CPN1 P15169 1/20 0.43
CPB2 Q96IY4 1/20 0.43
FFAR1 O14842 1/20 0.43
CHEK1 O14757 4/20 0.41
CDK2AP1 O14519 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GLA P06280 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
SLC6A4 P31645 1/20 0.38
SLC6A3 Q01959 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
SCHEMBL27626466 0.83 FFAR1 (0.50) KMT2AMEN1FFAR1ALDH1A1GLA
SCHEMBL8007179 0.83 KMT2A (0.67) KMT2AMEN1FFAR1ALDH1A1GLA
SCHEMBL4180738 0.81 FFAR1 (0.61) KMT2AMEN1FFAR1ALDH1A1GLA
SCHEMBL16475935 0.79 CPN1 (0.47) KMT2AMEN1CPN1CPB2SLC6A4
SCHEMBL28943723 0.76 PKM (0.45) SLC6A4SLC6A3
SCHEMBL22588872 0.76 CPN1 (0.39) KMT2ACPN1CPB2CHEK1SMN1; SMN2
SCHEMBL9996373 0.76 SLC6A2 (0.41) CHEK1CDK2AP1SLC6A4SLC6A3
SCHEMBL9996370 0.76 SLC6A2 (0.41) CHEK1CDK2AP1SLC6A4SLC6A3
SCHEMBL9996371 0.76 SLC6A2 (0.41) CHEK1CDK2AP1SLC6A4SLC6A3
SCHEMBL4022914 0.76 FFAR1 (0.55) KMT2AMEN1FFAR1ALDH1A1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005033068-A1 SOMATOSTATIN RECEPTOR 1 AND/OR 4 SELECTIVE AGONISTS AND ANTAGONISTS OY JUVANTIA PHARMA LTD (FI) 2005-04-14 WO disclosed