SCHEMBL25166127

SCHEMBL25166127

CC1CCOc2c1ccc(F)c2Br

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A P08913 2/20 0.33
▸ AKR1B1 P15121 1/20 0.32
▸ ADRA2B P18089 1/20 0.31
▸ ADRA2C P18825 1/20 0.31
▸ ADRA1A P35348 1/20 0.31

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
SCHEMBL31108011 1.00 ADRA2A (0.33) ADRA2AAKR1B1ADRA2BADRA2CADRA1A
SCHEMBL25166675 0.80 MAP3K14 (0.45) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL12828516 0.79 ADRA2A (0.50) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL14197670 0.79 ADRA2A (0.50) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL13498384 0.79 ADRA2A (0.50) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL25659973 0.76 ADRA2A (0.50) ADRA2AADRA2BADRA2CADRA1A
SCHEMBL25166247 0.73 — —
SCHEMBL16509739 0.72 KDM4E (0.40) ADRA2AADRA2BADRA1A
SCHEMBL16509702 0.72 KDM4E (0.40) ADRA2AADRA2BADRA1A
SCHEMBL8135027 0.72 ADRA2A (0.33) ADRA2A

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-2023064586-A1 NOVEL MODULATORS OF EHMT1 AND EHMT2 AND THERAPEUTIC USE THEREOF TANGO THERAPEUTICS, INC. (US) 2023-04-20 — — WO disclosed
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