SCHEMBL28665291

SCHEMBL28665291

CCOC(COc1ccc(F)cc1CBr)OCC

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.34
HIF1A Q16665 1/20 0.34
CACNA1C Q13936 1/20 0.34
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
GPR55 Q9Y2T6 1/20 0.33
SLC6A4 P31645 3/20 0.32
HTR2A P28223 2/20 0.32
KDM4E B2RXH2 1/20 0.32
SLC6A2 P23975 2/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
HPGD P15428 1/20 0.32
KMT2A Q03164 1/20 0.32
MAPK1 P28482 1/20 0.31
PKM P14618 2/20 0.31
HRH4 Q9H3N8 1/20 0.31
HTR2C P28335 1/20 0.31
HTR2B P41595 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
SCHEMBL28736105 0.88 HRH4 (0.33) HRH4
SCHEMBL18783749 0.83 ALDH1A1 (0.46) ALDH1A1HIF1AMAPTTHRBGPR55
SCHEMBL29679059 0.82 FFAR1 (0.43) SLC6A4KDM4EMEN1KMT2AMAPK1
SCHEMBL7480447 0.82 KDM4E (0.41) ALDH1A1MAPTKDM4EMEN1KMT2A
SCHEMBL4356588 0.82 PKM (0.49) ALDH1A1MAPTKDM4EMEN1POLB
SCHEMBL29678622 0.82 PKM (0.49) ALDH1A1MAPTKDM4EMEN1POLB
SCHEMBL9631905 0.82 FFAR1 (0.43) SLC6A4KDM4EMEN1KMT2AMAPK1
SCHEMBL12435311 0.79 FFAR1 (0.41) MAPTMEN1HPGDKMT2APKM
SCHEMBL29559341 0.77 FFAR1 (0.42) SLC6A4HTR2AKDM4EHTR2C
SCHEMBL24177168 0.77 MRGPRX4 (0.42) SLC6A4SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113636993-B Process for producing (5-fluoro-2, 3-dihydrobenzofuran-4-yl) methylamine or salt thereof, and intermediate therefor 苏州亚盛药业有限公司 2022-08-19 CN claimed
CN-113636993-A Process for producing (5-fluoro-2, 3-dihydrobenzofuran-4-yl) methylamine or salt thereof, and intermediate therefor 苏州亚盛药业有限公司 2021-11-12 CN claimed
CN-113636993-B Process for producing (5-fluoro-2, 3-dihydrobenzofuran-4-yl) methylamine or salt thereof, and intermediate therefor 苏州亚盛药业有限公司 2022-08-19 CN disclosed
CN-113636993-A Process for producing (5-fluoro-2, 3-dihydrobenzofuran-4-yl) methylamine or salt thereof, and intermediate therefor 苏州亚盛药业有限公司 2021-11-12 CN disclosed