SCHEMBL10359013

SCHEMBL10359013

N[C@H](Cc1c[nH]c2ccccc12)C(=O)OC(=O)[C@@H](N)Cc1ccc(O)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TACR1 P25103 2/20 0.62
KMT2A Q03164 3/20 0.61
KDM4E B2RXH2 3/20 0.61
MAPT P10636 3/20 0.61
LMNA P02545 2/20 0.61
TSHR P16473 2/20 0.61
BLM P54132 2/20 0.61
PMP22 Q01453 2/20 0.61
MEN1 O00255 2/20 0.61
MPO P05164 1/20 0.61
HIF1A Q16665 1/20 0.61
SLC6A2 P23975 2/20 0.59
OPRM1 P35372 2/20 0.53
OPRD1 P41143 2/20 0.53
MIF P14174 1/20 0.52
ERAP1 Q9NZ08 4/20 0.52
ERAP2 Q6P179 3/20 0.52
LNPEP Q9UIQ6 2/20 0.52
HTR1A P08908 2/20 0.51
HTR2A P28223 2/20 0.51

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
SCHEMBL243575 1.00 TACR1 (0.62) TACR1KMT2AKDM4EMAPTLMNA
Tyrosine SCHEMBL1065122 0.94 KMT2A (0.68) TACR1KMT2AKDM4EMAPTLMNA
SCHEMBL120931 0.91 KDM4E (0.69) TACR1KMT2AKDM4EMAPTLMNA
Tyrosine SCHEMBL9449484 0.91 KDM4E (0.63) TACR1KMT2AKDM4EMAPTLMNA
SCHEMBL289044 0.90 MAPT (0.74) TACR1KMT2AKDM4EMAPTLMNA
SCHEMBL475351 0.90 MAPT (0.74) TACR1KMT2AKDM4EMAPTLMNA
SCHEMBL2721523 0.88 BLM (0.67) TACR1KMT2AKDM4EMAPTLMNA
D-Tryptophan SCHEMBL10359012 0.88 KMT2A (0.80) TACR1KMT2AKDM4EMAPTLMNA
Tryptophan SCHEMBL6032938 0.88 KMT2A (0.80) TACR1KMT2AKDM4EMAPTLMNA
Tryptophan SCHEMBL15168746 0.88 KMT2A (0.80) TACR1KMT2AKDM4EMAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0215171-B1 PEPTIDES THE ADMINISTRATORS OF THE TULANE UNIVERSITY EDUCATIONAL FUND (US) 1990-11-22 EP claimed