SCHEMBL18436106

SCHEMBL18436106

C1=C(c2ccccc2)C=C(c2cc(C3=CC(c4ccccc4)=CC(c4ccccc4)N3)cc(-c3cc(-c4ccccc4)cc(-c4ccccc4)n3)c2)NC1c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP19A1 P11511 1/20 0.36
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ ADORA1 P30542 2/20 0.32
▸ ADORA3 P0DMS8 1/20 0.32
▸ ADORA2B P29275 1/20 0.32
▸ MCL1 Q07820 2/20 0.32
▸ ALDH1A1 P00352 3/20 0.31
▸ HPGD P15428 2/20 0.31
▸ ADORA2A P29274 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ MYC P01106 1/20 0.31
▸ XDH P47989 1/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ POLB P06746 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ CTRC Q99895 1/20 0.30

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
SCHEMBL22838126 1.00 CYP19A1 (0.36) CYP19A1MEN1KMT2AADORA1ADORA3
SCHEMBL18904013 0.90 MEN1 (0.34) CYP19A1MEN1KMT2AADORA1ALDH1A1
SCHEMBL23334400 0.89 CYP19A1 (0.35) CYP19A1MEN1KMT2AADORA1ADORA3
SCHEMBL17969932 0.86 ACACA (0.33) CYP19A1MEN1KMT2AMCL1HPGD
SCHEMBL5582405 0.85 MEN1 (0.43) MEN1KMT2AADORA1ADORA3ALDH1A1
SCHEMBL25622414 0.81 MEN1 (0.41) MEN1KMT2AADORA1ADORA3ALDH1A1
SCHEMBL13866584 0.81 HAO1 (0.32) —
SCHEMBL17306444 0.81 MEN1 (0.34) MEN1KMT2AHPGD
SCHEMBL17970033 0.79 ALOX5 (0.33) MEN1KMT2AHPGDSMN1; SMN2RAB9A
SCHEMBL23479227 0.79 HPGD (0.38) MEN1KMT2AADORA1ADORA3ALDH1A1

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
EP-3159350-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2017-04-26 — — EP disclosed
EP-3124488-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES Universal Display Corporation (US) 2017-02-01 — — EP disclosed
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