SCHEMBL28079813

SCHEMBL28079813

BrCNc1cccc(OCc2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 5/20 0.58
FFAR1 O14842 1/20 0.56
BCHE P06276 3/20 0.55
KDM4E B2RXH2 1/20 0.55
MEN1 O00255 1/20 0.55
ALDH1A1 P00352 1/20 0.55
GAA P10253 1/20 0.55
MAPT P10636 1/20 0.55
THRB P10828 1/20 0.55
PKM P14618 1/20 0.55
RAB9A P51151 1/20 0.55
BLM P54132 1/20 0.55
KMT2A Q03164 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55
CTSV O60911 1/20 0.53
CTSL P07711 1/20 0.53
CYP4F2 P78329 1/20 0.51
CYP4A11 Q02928 1/20 0.51
SIRT2 Q8IXJ6 1/20 0.51
MAOA P21397 1/20 0.50

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
SCHEMBL5310163 0.85 MEN1 (0.68) MAOBFFAR1BCHEKDM4EMEN1
SCHEMBL8167077 0.84 MAOB (0.58) MAOBFFAR1BCHEKDM4EMEN1
SCHEMBL13123460 0.84 FFAR1 (0.56) MAOBFFAR1BCHEKDM4EMEN1
SCHEMBL16334668 0.83 MAOB (0.62) MAOBFFAR1BCHEKDM4EMEN1
SCHEMBL6098127 0.81 CTSV (0.65) MAOBBCHEKDM4EMEN1ALDH1A1
SCHEMBL6571593 0.81 CYP4F2 (0.60) MAOBFFAR1BCHEKDM4EMEN1
SCHEMBL5287947 0.80 FFAR1 (0.62) MAOBFFAR1KDM4EMEN1ALDH1A1
SCHEMBL1566109 0.80 BCHE (0.54) MAOBFFAR1BCHEKDM4EMEN1
SCHEMBL11920270 0.80 BCHE (0.58) MAOBFFAR1BCHEKDM4EMEN1
SCHEMBL30490420 0.80 APP (0.74) MAOBBCHEKDM4EMEN1ALDH1A1

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
CN-103687857-B The fluoride ions indicator of kytoplasm 阿桑特研究公司 2016-11-09 CN disclosed