SCHEMBL28617264

SCHEMBL28617264

CC1(c2ccc(Br)cc2)CCc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 6/20 0.42
SIGMAR1 Q99720 2/20 0.42
AKR1B1 P15121 2/20 0.39
HDAC9 Q9UKV0 1/20 0.39
MAOB P27338 2/20 0.39
SLC18A3 Q16572 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.37
TP53 P04637 1/20 0.37
MAOA P21397 1/20 0.36
KDM1B Q8NB78 1/20 0.36
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
HTT P42858 1/20 0.35

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
SCHEMBL8849610 0.85 SIGMAR1 (0.50) KDM1ASIGMAR1HDAC9MAOBMEN1
SCHEMBL7457135 0.83 KDM1A (0.42) KDM1ASIGMAR1HDAC9MAOBMEN1
SCHEMBL28619354 0.83 HSD11B1 (0.44) KDM1ASIGMAR1AKR1B1MAOBTP53
SCHEMBL7453510 0.80 ATM (0.51) KDM1ASIGMAR1AKR1B1TP53
SCHEMBL14489209 0.79 KDM1A (0.42) KDM1ASIGMAR1HDAC9MAOBMEN1
SCHEMBL16892317 0.74 TDP1 (0.41) KDM1ASIGMAR1AKR1B1HDAC9MAOB
SCHEMBL11812318 0.72 CCR2 (0.44) KDM1ASIGMAR1TP53
SCHEMBL11308477 0.72 KDM1A (0.36) KDM1A
SCHEMBL2193462 0.72 KDM1A (0.43) KDM1ASIGMAR1
SCHEMBL14804302 0.72 MEN1 (0.45) AKR1B1MEN1KMT2AALDH1A1HPGD

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