SCHEMBL16158773

SCHEMBL16158773

c1ccc(-c2cc(-c3ccc(-c4cccc5c4ccc4c(-c6cc(-c7ccccc7)nc(-c7ccccc7)n6)cccc45)cc3)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 9/20 0.54
▸ KMT2A Q03164 9/20 0.54
▸ MAPT P10636 6/20 0.54
▸ ALDH1A1 P00352 6/20 0.54
▸ HPGD P15428 6/20 0.54
▸ NTSR1 P30989 1/20 0.54
▸ KDM4E B2RXH2 3/20 0.51
▸ LMNA P02545 3/20 0.51
▸ GLA P06280 1/20 0.51
▸ ADORA2A P29274 2/20 0.47
▸ ADORA1 P30542 2/20 0.47
▸ MAOB P27338 5/20 0.45
▸ MAOA P21397 3/20 0.45
▸ CYP2C19 P33261 2/20 0.44
▸ ACACA Q13085 1/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ CYP1A2 P05177 1/20 0.44

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
SCHEMBL16158682 0.97 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16158729 0.97 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL16158742 0.93 MEN1 (0.54) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17969935 0.93 MEN1 (0.58) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17970014 0.93 MEN1 (0.61) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17970020 0.93 MEN1 (0.61) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17969950 0.92 MEN1 (0.53) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17969997 0.92 MEN1 (0.53) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17969924 0.91 MEN1 (0.59) MEN1KMT2AMAPTALDH1A1HPGD
SCHEMBL17996240 0.91 MEN1 (0.59) MEN1KMT2AMAPTALDH1A1HPGD

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-9412954-B2 Heterocyclic compound and organic electronic element containing same LG CHEM, LTD. (KR) 2016-08-09 — — US disclosed
US-9412954-B2 Heterocyclic compound and organic electronic element containing same LG CHEM, LTD. (KR) 2016-08-09 — — US disclosed
US-20140299192-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME LG CHEM, LTD. (KR) 2014-10-09 — — US disclosed
US-20140299192-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC ELEMENT CONTAINING SAME LG CHEM, LTD. (KR) 2014-10-09 — — US disclosed
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