SCHEMBL28479583

SCHEMBL28479583

OC1(c2cccc3c2Cc2ccccc2-3)C=CC=C(Br)C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 3/20 0.38
NPC1 O15118 2/20 0.38
PNMT P11086 1/20 0.36
HTR2B P41595 3/20 0.36
HTR7 P34969 2/20 0.36
SRD5A2 P31213 1/20 0.35
HDAC9 Q9UKV0 1/20 0.32
HTR2C P28335 2/20 0.32
DRD2 P14416 1/20 0.32
ADRA1D P25100 1/20 0.32
HTR2A P28223 1/20 0.32
ADRA1A P35348 1/20 0.32
ADRA1B P35368 1/20 0.32
HSP90AA1 P07900 1/20 0.32
PDK2 Q15119 1/20 0.31
MAOA P21397 2/20 0.30
CYP1A2 P05177 1/20 0.30
ADRA2A P08913 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 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
SCHEMBL28481657 0.85 PNMT (0.37) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL28476540 0.84 PNMT (0.36) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL28470782 0.84 NPC1 (0.38) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL28482283 0.81 RAB9A (0.36) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL28475872 0.79 PNMT (0.36) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL28469714 0.77 PNMT (0.39) RAB9ANPC1PNMTHTR2BHTR7
SCHEMBL30559625 0.74 MEN1 (0.36) PDK2
SCHEMBL29044791 0.74 MEN1 (0.36) PDK2
SCHEMBL28327495 0.72 PNMT (0.37) RAB9ANPC1PNMTHTR2BHTR7
Formamide SCHEMBL28327358 0.69 PNMT (0.35) RAB9ANPC1PNMTHTR2BHTR7

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-111752101-A Photosensitive resin composition, cured film, substrate with cured film, and method for producing substrate with cured film 日铁化学材料株式会社 2020-10-09 CN disclosed