SCHEMBL28623848

SCHEMBL28623848

CC1(c2ccc(Br)cc2)CC(c2ccccc2)c2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.40
KDM1A O60341 3/20 0.37
RCOR1 Q9UKL0 1/20 0.37
HTR2A P28223 3/20 0.35
HTR2C P28335 2/20 0.35
HTR2B P41595 2/20 0.35
HRH3 Q9Y5N1 2/20 0.35
MAOA P21397 2/20 0.34
MAOB P27338 2/20 0.34

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
SCHEMBL28627161 0.87 SIGMAR1 (0.40) SIGMAR1KDM1AHTR2AMAOAMAOB
SCHEMBL28615808 0.85 SIGMAR1 (0.40) SIGMAR1
SCHEMBL28615619 0.79 KDM1A (0.43) SIGMAR1KDM1ARCOR1HTR2AHTR2C
SCHEMBL28025960 0.74 SIGMAR1 (0.49) SIGMAR1KDM1AHTR2AMAOAMAOB
SCHEMBL4582810 0.69 SIGMAR1 (0.47) SIGMAR1HTR2AMAOAMAOB
SCHEMBL11205351 0.69 SIGMAR1 (0.41) SIGMAR1KDM1AHTR2AMAOAMAOB
SCHEMBL11796945 0.68 SIGMAR1 (0.46) SIGMAR1HTR2AMAOAMAOB
SCHEMBL5309256 0.68 HTR2A (0.42) KDM1ARCOR1HTR2AHTR2CHTR2B
SCHEMBL2779458 0.67 DRD1 (0.38) SIGMAR1HTR2A
SCHEMBL30740070 0.67 DRD1 (0.38) SIGMAR1HTR2A

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-113365976-A Diphenylindane, triphenylindane and tetraphenylindan derivatives and their use in organic devices 多蒂肯独家合成控股公司 2021-09-07 CN disclosed