SCHEMBL30107989

SCHEMBL30107989

COCCOCc1cccc(Br)n1

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 2/20 0.38
MBOAT4 Q96T53 1/20 0.35
KCNH2 Q12809 1/20 0.34
KDM1A O60341 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
CHRNB2 P17787 1/20 0.33
CHRNA4 P43681 1/20 0.33
TSHR P16473 1/20 0.33
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32
HTR2A P28223 1/20 0.32
PARP1 P09874 1/20 0.31
MEN1 O00255 1/20 0.30
RECQL P46063 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 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
SCHEMBL7661242 0.87 KCNH2 (0.44) KCNH2TSHR
SCHEMBL1498867 0.84 MBOAT4 (0.36) HTR7MBOAT4KCNH2KDM1AMAOA
SCHEMBL22242022 0.84 KCNH2 (0.41) KCNH2TSHRMEN1RECQLKMT2A
SCHEMBL30539258 0.83 HTR7 (0.40) HTR7MBOAT4KCNH2KDM1AMAOA
SCHEMBL128886 0.83 HTR7 (0.40) HTR7MBOAT4KCNH2KDM1AMAOA
SCHEMBL28387454 0.83 KCNH2 (0.38) KCNH2TSHR
SCHEMBL3511340 0.80 HTR7 (0.41) HTR7MBOAT4KCNH2KDM1AMAOA
SCHEMBL24347496 0.77 ADORA2A (0.39) KCNH2TSHR
SCHEMBL29376088 0.76 IDH1 (0.42) MBOAT4MAOBHTR1ADRD2HTR2A
SCHEMBL3062205 0.75 TSHR (0.35) MBOAT4TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025076285-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITIONS THEREOF, AND METHODS OF USING THE SAME DELPHIA THERAPEUTICS, INC. (US) 2025-04-10 WO disclosed
WO-2022203399-A1 ADENOSINE A2A RECEPTOR ANTAGONIST AND USE THEREOF 주식회사 스탠다임 2022-09-29 WO disclosed