SCHEMBL23715375

SCHEMBL23715375

CC1(F)CCCNc2ccc(Br)cc21

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 4/20 0.33
BRD4 O60885 1/20 0.33
CMA1 P23946 1/20 0.33
AHR P35869 1/20 0.33
GAA P10253 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HSPA9 P38646 1/20 0.32
BACE2 Q9Y5Z0 1/20 0.32
CTSD P07339 1/20 0.32
LMNA P02545 2/20 0.32
PGR P06401 2/20 0.32
PKM P14618 1/20 0.32
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
RARG P13631 1/20 0.32
AKR1B1 P15121 1/20 0.31
PARP1 P09874 1/20 0.31
PARP10 Q53GL7 1/20 0.31
POLB P06746 1/20 0.31
CYP3A4 P08684 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
SCHEMBL1396642 0.77 RARB (0.49) BRD4CMA1AHRGAAL3MBTL1
SCHEMBL24275639 0.73 BACE1 (0.49) BACE1BACE2CTSDAPP
SCHEMBL6278100 0.73 PGR (0.37) BRD4CMA1AHRGAAL3MBTL1
SCHEMBL23714890 0.71 RARB (0.36) BACE1BRD4CMA1AHRGAA
SCHEMBL26145043 0.71 GAA (0.34) BACE1BRD4CMA1AHRGAA
SCHEMBL2343653 0.69 GAA (0.39) BRD4CMA1AHRGAAL3MBTL1
SCHEMBL23704986 0.69 BACE1 (0.41) BACE1LMNAAKR1B1
Hydrochloric Acid SCHEMBL6518062 0.68 GAA (0.38) BRD4CMA1AHRGAAL3MBTL1
SCHEMBL23715372 0.68 BACE1 (0.35) BACE1CMA1AHRBACE2CTSD
SCHEMBL21255481 0.67 CMA1 (0.36) BACE1BRD4CMA1AHRGAA

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-2021155316-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed