SCHEMBL8558133

SCHEMBL8558133

CC(C)C[C@H](N)CN1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.47
ALDH1A1 P00352 3/20 0.46
ANPEP P15144 2/20 0.46
LMNA P02545 2/20 0.37
ERAP2 Q6P179 1/20 0.37
ERAP1 Q9NZ08 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
KEAP1 Q14145 1/20 0.36
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
NFKB1 P19838 1/20 0.35
THPO P40225 1/20 0.35
KDM4E B2RXH2 4/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
NPC1 O15118 1/20 0.35
GMNN O75496 1/20 0.34
MAPT P10636 1/20 0.34
PMP22 Q01453 1/20 0.34

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
SCHEMBL8558131 1.00 USP2 (0.47) USP2ALDH1A1ANPEPLMNAERAP2
Trifluoroacetic Acid SCHEMBL8563404 0.84 ALDH1A1 (0.49) USP2ALDH1A1ANPEPLMNAKDM4E
Trifluoroacetic Acid SCHEMBL8563401 0.84 ALDH1A1 (0.49) USP2ALDH1A1ANPEPLMNAKDM4E
SCHEMBL372508 0.83 USP2 (0.58) USP2ALDH1A1ANPEPLMNASMN1; SMN2
SCHEMBL1619040 0.81 ANPEP (0.41) ALDH1A1ANPEPLMNAERAP2ERAP1
SCHEMBL1752333 0.81 ANPEP (0.41) ALDH1A1ANPEPLMNAERAP2ERAP1
SCHEMBL171329 0.79 MEN1 (0.43) ALDH1A1ANPEPLMNAERAP2ERAP1
SCHEMBL3954978 0.79 USP2 (0.50) USP2ALDH1A1ANPEPSMN1; SMN2KEAP1
SCHEMBL2715954 0.79 USP2 (0.54) USP2ALDH1A1ANPEPLMNASMN1; SMN2
SCHEMBL358783 0.79 USP2 (0.54) USP2ALDH1A1ANPEPLMNASMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0543861-B1 IMIDAZOPYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIOTECH PHARM (GB) 1998-10-14 EP disclosed
US-5276153-A Antagonist of platelet activating factor for bronchodilation BRITISH BIO-TECHNOLOGY LIMITED (GB) 1994-01-04 US disclosed
EP-0543861-A1 IMIDAZOPYRIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-06-02 EP disclosed
US-5180723-A Hypertensives, bronchodilators, antiedemic agents BRITISH BIO-TECHNOLOGY LIMITED (GB) 1993-01-19 US disclosed
WO-1992003422-A1 BENZIMIDAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR APPLICATION BRITISH BIO-TECHNOLOGY LIMITED (GB) 1992-03-05 WO disclosed