SCHEMBL6607797

SCHEMBL6607797

CN(c1nc(C(N)=O)co1)S(C)(=O)=O

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.31

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
SCHEMBL3356016 0.85 CES1 (0.34) ALDH1A1
SCHEMBL3351523 0.78 CYP1A2 (0.43) ALDH1A1LMNA
SCHEMBL6630016 0.69 ALDH1A1 (0.41) ALDH1A1LMNA
SCHEMBL27411717 0.69 ALDH1A1 (0.41) ALDH1A1LMNA
SCHEMBL3128733 0.68 PIK3C3 (0.35) ALDH1A1LMNA
SCHEMBL6602469 0.68 HTR2B (0.39) ALDH1A1LMNA
SCHEMBL303734 0.67
SCHEMBL22598045 0.65 ALDH1A1 (0.42) ALDH1A1
SCHEMBL23592889 0.65
SCHEMBL709372 0.65 ALDH1A1 (0.52) ALDH1A1LMNA

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-1395251-A2 AMINEDIOLS AS AGENTS FOR THE TREATMENT OF ALZHEIMER'S DISEASE Elan Pharmaceuticals, Inc. (US) 2004-03-10 EP disclosed
WO-2002100818-A2 AMINEDIOLS AS AGENTS FOR THE TREATMENT OF ALZHEIMER'S DISEASE ELAN PHARMACEUTICALS, INC. (US) 2002-12-19 WO disclosed