SCHEMBL14948405

SCHEMBL14948405

C[N+](C)(Cc1ccc(N(c2ccccc2)c2ccccc2)cc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
CRHBP P24387 1/20 0.39
ATM Q13315 1/20 0.39
CRHR2 Q13324 1/20 0.39
TLR9 Q9NR96 1/20 0.39
CNR2 P34972 1/20 0.37
TSHR P16473 1/20 0.36
DNM1 Q05193 2/20 0.36
ACHE P22303 2/20 0.36

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
SCHEMBL14948335 0.91 CYP2C19 (0.43) ALDH1A1KDM4ETDP1L3MBTL1CYP1A2
SCHEMBL14948410 0.90 CNR2 (0.38) ALDH1A1KDM4ETDP1L3MBTL1CYP1A2
SCHEMBL25945658 0.85 ALDH1A1 (0.47) ALDH1A1KDM4ETDP1CYP3A4MAPT
SCHEMBL31325834 0.82 TP53 (0.52) ALDH1A1KDM4ETDP1CYP1A2MEN1
SCHEMBL565108 0.82 KDM4E (0.58) ALDH1A1KDM4ETDP1MEN1KMT2A
Bromide SCHEMBL6122965 0.80 KDM4E (0.56) ALDH1A1KDM4ETDP1MEN1KMT2A
Water SCHEMBL9684775 0.80 KDM4E (0.56) ALDH1A1KDM4ETDP1MEN1KMT2A
Iodide SCHEMBL22188504 0.80 KDM4E (0.56) ALDH1A1KDM4ETDP1MEN1KMT2A
SCHEMBL21747552 0.80 KDM4E (0.56) ALDH1A1KDM4ETDP1MEN1KMT2A
Hydrochloric Acid SCHEMBL1559083 0.80 KDM4E (0.62) ALDH1A1KDM4ETDP1MEN1KMT2A

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
US-9184388-B2 Layered structure, electronic device using same, aromatic compound, and method for manufacturing said compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-11-10 US disclosed
US-20130119369-A1 LAYERED STRUCTURE, ELECTRONIC DEVICE USING SAME, AROMATIC COMPOUND, AND METHOD FOR MANUFACTURING SAID COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-05-16 US disclosed