SCHEMBL21455985

SCHEMBL21455985

CNCCOCCOCCONC

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR1D P28221 1/20 0.33
HTR1B P28222 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
TAAR1 Q96RJ0 1/20 0.30

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
SCHEMBL21553563 0.88 HTR1B (0.39) HTR1DHTR1BMEN1KMT2A
SCHEMBL8403572 0.88 HTR1B (0.39) HTR1DHTR1BMEN1KMT2A
SCHEMBL22276507 0.88 HTR1B (0.39) HTR1DHTR1BMEN1KMT2A
SCHEMBL1254865 0.88 HTR1B (0.39) HTR1DHTR1BMEN1KMT2A
SCHEMBL22276504 0.88 HTR1B (0.39) HTR1DHTR1BMEN1KMT2A
SCHEMBL11803352 0.85
SCHEMBL10105739 0.85 MEN1 (0.33) MEN1KMT2A
SCHEMBL301651 0.85
SCHEMBL11613606 0.85 MEN1 (0.33) MEN1KMT2A
SCHEMBL24378505 0.78 ALDH1A1 (0.39) HTR1DHTR1BMEN1KMT2A

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
WO-2019195201-A1 BRM TARGETING COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2019-10-10 WO disclosed