SCHEMBL7232184

SCHEMBL7232184

CCOC(=O)C1CCCN(C(=O)Cc2cccs2)C1

nearest known ligand 0.76

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.76
MEN1 O00255 2/20 0.76
HSD17B10 Q99714 1/20 0.76
ALDH1A1 P00352 8/20 0.69
KDM4E B2RXH2 3/20 0.69
POLB P06746 2/20 0.65
GAA P10253 1/20 0.60
SMN1; SMN2 Q16637 3/20 0.60
HPGD P15428 2/20 0.60
NPC1 O15118 2/20 0.59
TSHR P16473 2/20 0.59
RAB9A P51151 1/20 0.59
CYP3A4 P08684 1/20 0.57
CYP2D6 P10635 1/20 0.57
CYP2C9 P11712 1/20 0.57
CYP2C19 P33261 1/20 0.57
HTT P42858 1/20 0.55

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
SCHEMBL7233937 0.89 ALDH1A1 (0.70) KMT2AMEN1HSD17B10ALDH1A1KDM4E
SCHEMBL7234226 0.85 MEN1 (0.57) KMT2AMEN1HSD17B10ALDH1A1KDM4E
SCHEMBL6794958 0.83 MAPT (0.58) KMT2AMEN1HSD17B10ALDH1A1KDM4E
SCHEMBL7232816 0.83 MAPT (0.58) KMT2AMEN1HSD17B10ALDH1A1KDM4E
SCHEMBL7234671 0.83 KMT2A (0.60) KMT2AMEN1HSD17B10ALDH1A1KDM4E
Ammonia Solution, Strong SCHEMBL7239598 0.82 MAPT (0.57) KMT2AMEN1HSD17B10ALDH1A1KDM4E
Ammonia Solution, Strong SCHEMBL7239595 0.82 MAPT (0.57) KMT2AMEN1HSD17B10ALDH1A1KDM4E
SCHEMBL7233063 0.82 MAPT (0.54) KMT2AMEN1HSD17B10ALDH1A1KDM4E
SCHEMBL7232704 0.82 MAPT (0.54) KMT2AMEN1HSD17B10ALDH1A1KDM4E
SCHEMBL7242700 0.82 HSD17B10 (0.69) KMT2AMEN1HSD17B10ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6664271-B1 Amide, carbamate and uredo derivatives of 3-piperidine-carboxylic acid or ester; protecting against infection by such as escherichia coli and/or actinobacillus pleuropneumoniae ELI LILLY AND COMPANY 2003-12-16 US claimed
WO-2000071519-A2 IMMUNOPOTENTIATOR AGENTS ELI LILLY AND COMPANY (US) 2000-11-30 WO claimed
US-6664271-B1 Amide, carbamate and uredo derivatives of 3-piperidine-carboxylic acid or ester; protecting against infection by such as escherichia coli and/or actinobacillus pleuropneumoniae ELI LILLY AND COMPANY 2003-12-16 US disclosed