SCHEMBL27983608

SCHEMBL27983608

N#CC(=Cc1ccccc1)c1nc2ccccc2[nH]1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 8/20 0.82
▸ KDM4E B2RXH2 5/20 0.82
▸ THRB P10828 1/20 0.80
▸ MEN1 O00255 8/20 0.76
▸ KMT2A Q03164 8/20 0.76
▸ NPSR1 Q6W5P4 3/20 0.76
▸ ALDH1A1 P00352 2/20 0.76
▸ NSD2 O96028 1/20 0.72
▸ BLM P54132 1/20 0.72
▸ CYP1A2 P05177 1/20 0.69
▸ CYP2C9 P11712 1/20 0.69
▸ CYP2C19 P33261 1/20 0.69
▸ POLB P06746 6/20 0.66
▸ USP2 O75604 2/20 0.66
▸ TNNI3 P19429 1/20 0.66
▸ TNNT2 P45379 1/20 0.66
▸ RECQL P46063 1/20 0.66
▸ TNNC1 P63316 1/20 0.66
▸ MCOLN3 Q8TDD5 1/20 0.66
▸ NPC1 O15118 6/20 0.66

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
SCHEMBL10476384 0.90 THRB (0.79) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL5594708 0.84 MEN1 (1.00) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL12881142 0.84 MEN1 (1.00) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL10476383 0.83 KMT2A (0.73) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL10476385 0.83 KMT2A (0.73) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL27983596 0.83 MAPT (0.78) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL5594404 0.81 APP (0.64) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL12881130 0.81 MEN1 (0.76) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL5594542 0.80 MAPT (1.00) MAPTKDM4ETHRBMEN1KMT2A
SCHEMBL12351294 0.80 MAPT (0.83) MAPTKDM4ETHRBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104016973-B A kind of method preparing two aromatic rings substituted olefines 台州学院 2016-11-02 — — CN disclosed
CN-104016973-A New method for preparing double-(hetero)aromatic-ring substituted alkene UNIV TAIZHOU 2014-09-03 — — CN disclosed
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