SCHEMBL475351

SCHEMBL475351

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

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.74
KDM4E B2RXH2 2/20 0.74
MEN1 O00255 2/20 0.74
LMNA P02545 2/20 0.74
KMT2A Q03164 2/20 0.74
MPO P05164 1/20 0.74
TSHR P16473 1/20 0.74
BLM P54132 1/20 0.74
PMP22 Q01453 1/20 0.74
HIF1A Q16665 1/20 0.74
TACR1 P25103 2/20 0.66
HTR2A P28223 2/20 0.59
ADRB1 P08588 1/20 0.59
HTR1A P08908 1/20 0.59
ADRA2A P08913 1/20 0.59
SLC6A2 P23975 1/20 0.59
HTR1D P28221 1/20 0.59
HTR1B P28222 1/20 0.59
HTR2C P28335 1/20 0.59
HTR1E P28566 1/20 0.59

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
SCHEMBL289044 1.00 MAPT (0.74) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL27645874 0.95 MAPT (0.67) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL4261073 0.95 MAPT (0.67) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL21059260 0.94 MAPT (0.70) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL120931 0.93 KDM4E (0.69) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL8406415 0.93 MAPT (0.65) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL5065255 0.93 KDM4E (0.65) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL17503190 0.93 MAPT (0.72) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL1640627 0.93 MAPT (0.68) MAPTKDM4EMEN1LMNAKMT2A
SCHEMBL626831 0.93 MAPT (0.72) MAPTKDM4EMEN1LMNAKMT2A

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-2260034-B9 PROCESS FOR THE PREPARATION OF 2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLIN-3-CARBOXYLIC ACID ESTERS ENDURA SPA (IT) 2012-11-07 EP claimed
EP-2260034-B1 PROCESS FOR THE PREPARATION OF 2,3,4,9-TETRAHYDRO-1H-BETA-CARBOLIN-3-CARBOXYLIC ACID ESTERS ENDURA SPA (IT) 2012-02-01 EP claimed
EP-1546149-B1 MODIFIED PICTET-SPENGLER REACTION AND PRODUCTS PREPARED THEREFROM LILLY ICOS LLC (US) 2008-11-26 EP claimed
US-6015698-A CONTACTING MIXTURE OF ENANTIOMERS OF AN AMINO ACID WITH A MICROORGANISM WHICH SELECTIVELY DEGRADES THE L-AMINO ACID TO PRODUCE THE AMINE, THEN RECOVERING THE D-AMINO ACID; EFFICIENT PROCESS FOR THE INDUSTRIAL PRODUCTION OF DRUGS DAICEL CHEMICAL INDUSTRIES, LTD. (JP) 2000-01-18 US disclosed