SCHEMBL9664229

SCHEMBL9664229

CCCCCCCCCCCCCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.62
HCRTR1 O43613 1/20 0.62
KMT2A Q03164 1/20 0.62
MTNR1A P48039 2/20 0.61
ECE1 P42892 2/20 0.59
HDAC3 O15379 3/20 0.57
HDAC4 P56524 3/20 0.57
HDAC1 Q13547 3/20 0.57
HDAC7 Q8WUI4 3/20 0.57
HDAC2 Q92769 3/20 0.57
HDAC10 Q969S8 3/20 0.57
HDAC11 Q96DB2 3/20 0.57
HDAC8 Q9BY41 3/20 0.57
HDAC6 Q9UBN7 3/20 0.57
HDAC9 Q9UKV0 3/20 0.57
HDAC5 Q9UQL6 3/20 0.57
KDM4E B2RXH2 1/20 0.56
ALDH1A1 P00352 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.56
MMP2 P08253 4/20 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
SCHEMBL9664095 1.00 MEN1 (0.62) MEN1HCRTR1KMT2AMTNR1AECE1
SCHEMBL9664053 1.00 MEN1 (0.62) MEN1HCRTR1KMT2AMTNR1AECE1
SCHEMBL9664238 1.00 MEN1 (0.62) MEN1HCRTR1KMT2AMTNR1AECE1
SCHEMBL9664767 1.00 MEN1 (0.62) MEN1HCRTR1KMT2AMTNR1AECE1
SCHEMBL9664181 0.99 MEN1 (0.64) MEN1HCRTR1KMT2AMTNR1AECE1
SCHEMBL24122290 0.96 ECE1 (0.60) MEN1HCRTR1KMT2AMTNR1AECE1
SCHEMBL8221748 0.92 MEN1 (0.64) MEN1HCRTR1KMT2AMTNR1AHDAC3
SCHEMBL20314886 0.91 MEN1 (0.65) MEN1HCRTR1KMT2AMTNR1AHDAC3
SCHEMBL25189279 0.90 MEN1 (0.64) MEN1HCRTR1KMT2AMTNR1AKDM4E
SCHEMBL21001587 0.90 MEN1 (0.64) MEN1HCRTR1KMT2AMTNR1AKDM4E

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-0473700-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1992-03-11 EP claimed
WO-1990014429-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1990-11-29 WO claimed
EP-0473700-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1992-03-11 EP disclosed
WO-1990014429-A1 AN ENZYME-CATALYZED PROCESS FOR PREPARING N-ACYL AMINO ACIDS AND N-ACYL AMINO ACID AMIDES NOVO NORDISK A/S (DK) 1990-11-29 WO disclosed