SCHEMBL15909741

SCHEMBL15909741

N#Cc1ccc(N(c2ccccc2)c2cc3ccc4cccc5ccc(c2)c3c45)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.40
TDP1 Q9NUW8 2/20 0.40
CYP1A1 P04798 2/20 0.40
CYP1B1 Q16678 2/20 0.40
TSHR P16473 3/20 0.39
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
MAOA P21397 2/20 0.36
MAOB P27338 1/20 0.36
CYP1A2 P05177 3/20 0.35
MAPT P10636 2/20 0.35
ALDH1A1 P00352 2/20 0.35
CYP3A4 P08684 2/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
MEN1 O00255 3/20 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
SCHEMBL15731011 0.95 KDM4E (0.43) KDM4ETDP1CYP1A1CYP1B1TSHR
SCHEMBL15909735 0.93 GABRA1 (0.40) KDM4ETDP1CYP1A1CYP1B1TSHR
SCHEMBL16272131 0.91 KDM4E (0.40) KDM4ETDP1CYP1A1CYP1B1TSHR
SCHEMBL20243301 0.88 MYC (0.39) KDM4ETSHRCRHBPCRHR2PTGDR2
SCHEMBL15909753 0.88 ALDH1A1 (0.39) KDM4ETDP1TSHRCA1CA2
SCHEMBL16271341 0.87 KCNN4 (0.38) KDM4ETDP1CYP1A1CYP1B1TSHR
SCHEMBL14069630 0.87 ALDH1A1 (0.46) KDM4ETDP1CYP1A1CYP1B1TSHR
SCHEMBL15731012 0.85 ALDH1A1 (0.48) KDM4ETDP1CYP1A1CYP1B1TSHR
SCHEMBL20243314 0.85 ALDH1A1 (0.48) KDM4ETDP1CYP1A1CYP1B1TSHR
SCHEMBL15909736 0.84 CA1 (0.43) KDM4ETDP1CYP1A1CYP1B1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9997713-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-12 US disclosed
US-9997713-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-12 US disclosed
US-20140209875-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed
US-20140209875-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed