SCHEMBL19618579

SCHEMBL19618579

c1ccc2cc(-c3cc(-c4ccc(-c5ccc6ccccc6n5)cc4)c4cc(-c5cc6ccccc6c6ccccc56)ccc4n3)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACACA Q13085 4/20 0.47
▸ KDM4E B2RXH2 6/20 0.45
▸ ALDH1A1 P00352 6/20 0.45
▸ NPC1 O15118 5/20 0.45
▸ RAB9A P51151 5/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.45
▸ NFKB1 P19838 2/20 0.45
▸ NFKB2 Q00653 2/20 0.45
▸ RELA Q04206 2/20 0.45
▸ MEN1 O00255 4/20 0.44
▸ KMT2A Q03164 4/20 0.44
▸ AR P10275 2/20 0.44
▸ MAPT P10636 4/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ HPGD P15428 2/20 0.43
▸ GMNN O75496 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ THPO P40225 1/20 0.43
▸ BLM P54132 1/20 0.43

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
SCHEMBL19618580 0.94 ACACA (0.43) ACACAKDM4EALDH1A1NPC1RAB9A
SCHEMBL19618438 0.91 NPC1 (0.48) ACACAKDM4EALDH1A1NPC1RAB9A
SCHEMBL19618281 0.91 KDM4E (0.50) ACACAKDM4EALDH1A1NPC1RAB9A
SCHEMBL19618578 0.88 MEN1 (0.44) ACACAKDM4EALDH1A1NPC1RAB9A
SCHEMBL19618602 0.88 ACACA (0.47) ACACAKDM4EALDH1A1MEN1KMT2A
SCHEMBL19618603 0.88 ACACA (0.47) ACACAKDM4EALDH1A1MEN1KMT2A
SCHEMBL19618601 0.88 CYP1A1 (0.49) ACACAKDM4EALDH1A1MEN1KMT2A
SCHEMBL19618596 0.88 CYP1A1 (0.49) ACACAKDM4EALDH1A1MEN1KMT2A
SCHEMBL19618600 0.86 ACACA (0.45) ACACAKDM4EALDH1A1NPC1RAB9A
SCHEMBL19618452 0.86 NPC1 (0.43) ACACAKDM4EALDH1A1NPC1RAB9A

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-9825242-B2 Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode CHEIL INDUSTRIES, INC. (KR) 2017-11-21 — — US disclosed
US-9825242-B2 Compound for organic optoelectric device, organic light-emitting diode including same, display device including organic light-emitting diode CHEIL INDUSTRIES, INC. (KR) 2017-11-21 — — US disclosed
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