SCHEMBL16548671

SCHEMBL16548671

N#Cc1ccc2c(c1)c1cc(-c3c4ccccc4c(-c4c5ccccc5cc5ccccc45)c4ccccc34)ccc1n2-c1ccccn1

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SLC11A2 P49281 2/20 0.39
▸ GRM5 P41594 6/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ HPGD P15428 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ PLAUR Q03405 1/20 0.38
▸ CA1 P00915 2/20 0.36
▸ CA2 P00918 2/20 0.36
▸ HRH1 P35367 1/20 0.35
▸ HTR6 P50406 1/20 0.35
▸ ENPP3 O14638 1/20 0.35
▸ PTGER4 P35408 2/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ DDB1 Q16531 1/20 0.34
▸ CRBN Q96SW2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ METAP2 P50579 1/20 0.33
▸ METAP1 P53582 1/20 0.33

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
SCHEMBL16549079 0.88 GRM5 (0.39) SLC11A2GRM5MEN1LMNAHPGD
SCHEMBL31573826 0.84 GRM5 (0.47) SLC11A2GRM5PLAURHRH1HTR6
SCHEMBL16548673 0.83 HTR1A (0.40) MEN1LMNAHPGDKMT2ACA1
SCHEMBL16549007 0.83 GRM5 (0.42) SLC11A2GRM5PLAURCA1CA2
SCHEMBL16548669 0.82 CA1 (0.40) MEN1KMT2ACA1CA2ENPP3
SCHEMBL16456252 0.81 GRM5 (0.38) SLC11A2GRM5MEN1LMNAHPGD
SCHEMBL16548672 0.80 CYP1A2 (0.38) MEN1LMNAKMT2ACA1CA2
SCHEMBL16456288 0.80 GRM5 (0.39) SLC11A2GRM5MEN1LMNAHPGD
SCHEMBL16456289 0.80 GRM5 (0.35) SLC11A2GRM5MEN1LMNAHPGD
SCHEMBL16548670 0.80 CA1 (0.38) CA1CA2ENPP3PTGER4ALOX5

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-9716234-B2 Compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-25 — — US disclosed
US-20150060787-A1 COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-05 — — US disclosed
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