SCHEMBL6818262

SCHEMBL6818262

CCCCCCCCCCCCCC(=O)n1nnc2ccc(Cl)cc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.53
KMT2A Q03164 2/20 0.53
LMNA P02545 1/20 0.53
KMO O15229 1/20 0.49
ASAH1 Q13510 1/20 0.45
NPC1 O15118 1/20 0.42
GLA P06280 1/20 0.41
THRB P10828 1/20 0.41
MAPT P10636 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
P2RX7 Q99572 1/20 0.41
GSK3B P49841 4/20 0.40
OXER1 Q8TDS5 2/20 0.40
F12 P00748 1/20 0.39
MGAM O43451 1/20 0.39
AMY1A P0DUB6 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39

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
SCHEMBL5790971 0.90 HPGD (0.53) HPGDKMT2ALMNAKMOASAH1
SCHEMBL535029 0.81 ASAH1 (0.66) HPGDKMT2ALMNAASAH1MAPT
SCHEMBL534984 0.81 ASAH1 (0.66) HPGDKMT2ALMNAASAH1MAPT
SCHEMBL535094 0.81 ASAH1 (0.66) HPGDKMT2ALMNAASAH1MAPT
SCHEMBL5793440 0.81 ASAH1 (0.66) HPGDKMT2ALMNAASAH1MAPT
SCHEMBL18206302 0.81 ASAH1 (0.66) HPGDKMT2ALMNAASAH1MAPT
SCHEMBL337266 0.81 ASAH1 (0.66) HPGDKMT2ALMNAASAH1MAPT
SCHEMBL6819471 0.80 MGAM (0.50) HPGDKMT2ALMNAASAH1MAPT
SCHEMBL535030 0.80 ASAH1 (0.64) HPGDKMT2ALMNAASAH1MAPT
SCHEMBL6818371 0.78 KCNMA1 (0.50) HPGDKMT2ALMNAASAH1MAPT

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-0938502-B1 SELECTIVE ACYLATION METHOD NOVO NORDISK AS (DK) 2004-10-06 EP disclosed
EP-0938502-A1 SELECTIVE ACYLATION METHOD NOVO NORDISK A/S (DK) 1999-09-01 EP disclosed
US-5905140-A ACYLATING INSULIN, INSULIN ANALOGS, AND INSULIN PRECURSORS ON FREE EPSILON-AMINO GROUP OF LYSINE USING ACTIVATED AMIDE WITH ACYL GROUP IN POLAR SOLVENT IN PRESENCE OF BASE NOVO NORDISK A/S, NOVO ALLE (DK) 1999-05-18 US disclosed
WO-1998002460-A1 SELECTIVE ACYLATION METHOD NOVO NORDISK A/S (DK) 1998-01-22 WO disclosed