SCHEMBL10384697

SCHEMBL10384697

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

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.60
ADRB1 P08588 1/20 0.60
HTR1A P08908 1/20 0.60
ADRA2A P08913 1/20 0.60
SLC6A2 P23975 1/20 0.60
HTR1D P28221 1/20 0.60
HTR1B P28222 1/20 0.60
HTR2C P28335 1/20 0.60
HTR1E P28566 1/20 0.60
SLC6A4 P31645 1/20 0.60
HTR7 P34969 1/20 0.60
HTR2B P41595 1/20 0.60
HTR6 P50406 1/20 0.60
SLC6A3 Q01959 1/20 0.60
MAPT P10636 3/20 0.55
MEN1 O00255 3/20 0.55
KMT2A Q03164 3/20 0.55
KDM4E B2RXH2 2/20 0.55
LMNA P02545 1/20 0.55
MPO P05164 1/20 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
SCHEMBL10384622 0.86 HTR2A (0.58) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL10384652 0.81 MAPT (0.62) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL8724312 0.79 KMT2A (0.57) MAPTMEN1KMT2AKDM4ELMNA
SCHEMBL20424353 0.76 HTR2A (0.67) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL5739268 0.76 HTR2A (1.00) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL29886359 0.76 HTR2A (1.00) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL274268 0.76 HTR2A (1.00) HTR2AADRB1HTR1AADRA2ASLC6A2
SCHEMBL599674 0.76 HTR2A (1.00) HTR2AADRB1HTR1AADRA2ASLC6A2
Tryptophan Methyl Ester SCHEMBL4400782 0.76 MAPT (0.62) HTR2AADRB1HTR1AADRA2ASLC6A2
Tryptophan Methyl Ester SCHEMBL4400781 0.76 MAPT (0.62) HTR2AADRB1HTR1AADRA2ASLC6A2

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
US-4946833-A ANTITUMOR AGENTS ADIR ET CIE (FR) 1990-08-07 US disclosed