SCHEMBL28686176

SCHEMBL28686176

CC(Cc1ccccc1)(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
LMNA P02545 1/20 0.45
GAA P10253 1/20 0.45
GPR84 Q9NQS5 3/20 0.44
ATM Q13315 1/20 0.43
SLC6A2 P23975 3/20 0.42
FNTA P49354 1/20 0.42
FNTB P49356 1/20 0.42
CYP3A4 P08684 2/20 0.42
MAPT P10636 1/20 0.42
AHR P35869 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
FFAR1 O14842 1/20 0.41
TRPM8 Q7Z2W7 1/20 0.41
TRPV1 Q8NER1 1/20 0.41
HTR6 P50406 2/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL2944736 0.80 SLC6A2 (0.47) MEN1KMT2ALMNAGPR84SLC6A2
SCHEMBL30437029 0.76 ATM (0.54) MEN1KMT2AGPR84ATMSLC6A2
SCHEMBL13335152 0.76 ATM (0.54) MEN1KMT2AGPR84ATMSLC6A2
SCHEMBL29885789 0.76 ATM (0.54) MEN1KMT2AGPR84ATMSLC6A2
SCHEMBL799601 0.76 ATM (0.54) MEN1KMT2AGPR84ATMSLC6A2
SCHEMBL1685393 0.76 ATM (0.54) MEN1KMT2AGPR84ATMCYP3A4
SCHEMBL5822298 0.75 MAPT (0.44) MEN1KMT2AGPR84ATMCYP3A4
SCHEMBL27825447 0.75 SLC6A2 (0.42) MEN1KMT2ALMNAGAAGPR84
SCHEMBL8001498 0.75 SLC6A2 (0.45) MEN1KMT2AGPR84SLC6A2FNTA
SCHEMBL14168906 0.74 HTR2A (0.54) MEN1KMT2ALMNAGPR84CYP3A4

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-113292475-A Preparation method of bis-indole phenethylene compound 黄山金石木塑料科技有限公司 2021-08-24 CN disclosed