SCHEMBL23714599

SCHEMBL23714599

Cc1ncc(Br)cc1C(=O)N(C)OI

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
PIK3C3 Q8NEB9 3/20 0.34
OPRK1 P41145 12/20 0.34
ALDH1A1 P00352 1/20 0.33
APOBEC3A P31941 1/20 0.30
APOBEC3G Q9HC16 1/20 0.30
CNR2 P34972 1/20 0.30
HPGD P15428 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
SCHEMBL21591708 0.86 OPRK1 (0.37) MEN1KMT2APIK3C3OPRK1ALDH1A1
SCHEMBL30041415 0.86 OPRK1 (0.37) MEN1KMT2APIK3C3OPRK1ALDH1A1
SCHEMBL23705904 0.81 PIK3CA (0.35) MEN1KMT2APIK3C3OPRK1ALDH1A1
SCHEMBL23705905 0.79 PIK3CA (0.34) MEN1KMT2APIK3C3OPRK1ALDH1A1
SCHEMBL16926840 0.75 PIK3C3 (0.46) MEN1KMT2APIK3C3OPRK1ALDH1A1
SCHEMBL473906 0.73 KDM4E (0.46) MEN1KMT2APIK3C3OPRK1ALDH1A1
SCHEMBL18068209 0.73 SMN1; SMN2 (0.52) OPRK1ALDH1A1
SCHEMBL30963156 0.73 KDM4E (0.46) MEN1KMT2APIK3C3OPRK1ALDH1A1
SCHEMBL17001153 0.72 PIK3C3 (0.34) PIK3C3OPRK1ALDH1A1
SCHEMBL18634029 0.72 PIK3C3 (0.33) PIK3C3OPRK1ALDH1A1CNR2

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-2021155320-A1 COMPOUNDS AND USES THEREOF FOGHORN THERAPEUTICS INC. (US) 2021-08-05 WO disclosed