SCHEMBL6630165

SCHEMBL6630165

NCCc1ccc(OC(=O)Nc2ccccc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.68
ALDH1A1 P00352 4/20 0.60
GAA P10253 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
HTT P42858 1/20 0.60
MAPT P10636 3/20 0.53
KDM4E B2RXH2 2/20 0.51
THRB P10828 2/20 0.51
GFER P55789 2/20 0.51
TDP1 Q9NUW8 2/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
RAD51 Q06609 1/20 0.51
GLA P06280 1/20 0.51
BLM P54132 1/20 0.51
CASP6 P55212 1/20 0.51
LMNA P02545 1/20 0.51
TP53 P04637 1/20 0.51
ADRB1 P08588 1/20 0.50
ADRB3 P13945 1/20 0.50

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
SCHEMBL12218372 0.85 RAB9A (0.78) RAB9AALDH1A1GAASMN1; SMN2HTT
SCHEMBL29233073 0.82 RAB9A (0.74) RAB9AALDH1A1GAASMN1; SMN2HTT
SCHEMBL9200925 0.82 GAA (0.73) RAB9AALDH1A1GAASMN1; SMN2HTT
SCHEMBL16192982 0.81 ALDH1A1 (0.64) RAB9AALDH1A1GAASMN1; SMN2HTT
SCHEMBL1954988 0.81 RAB9A (1.00) RAB9AALDH1A1GAASMN1; SMN2HTT
SCHEMBL29233062 0.81 RAB9A (0.72) RAB9AALDH1A1GAASMN1; SMN2HTT
SCHEMBL29233138 0.80 RAB9A (0.70) RAB9AALDH1A1GAASMN1; SMN2HTT
SCHEMBL29233089 0.80 RAB9A (0.70) RAB9AALDH1A1GAASMN1; SMN2HTT
SCHEMBL1839911 0.80 RAB9A (0.70) RAB9AALDH1A1GAASMN1; SMN2HTT
Phenyl Phenylcarbamate SCHEMBL272994 0.80 ALDH1A1 (0.76) RAB9AALDH1A1GAASMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1458375-A2 COMPOSITIONS FOR DECREASING ACTIVITY OF HORMONE-SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-09-22 EP disclosed
EP-1458374-A2 COMPOUNDS AND USES THEREOF FOR DECREASING ACTIVITY OF HORMONE-SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2004-09-22 EP disclosed
WO-2003051842-A2 COMPOSITIONS DECREASING ACTIVITY OF HORMONE-SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2003-06-26 WO disclosed
WO-2003051841-A2 COMPOUNDS AND USES THEREOF FOR DECREASING ACTIVITY OF HORMONE-SENSITIVE LIPASE NOVO NORDISK A/S (DK) 2003-06-26 WO disclosed