SCHEMBL21982143

SCHEMBL21982143

Cc1cc(-c2cccc(-c3nc(-c4ccccc4)nc(-c4ccccc4)n3)c2)c(C)cn1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 3/20 0.46
▸ LMNA P02545 2/20 0.42
▸ CYP1A2 P05177 2/20 0.41
▸ KDR P35968 2/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ PDGFRB P09619 1/20 0.41
▸ FLT3 P36888 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ABL1 P00519 2/20 0.39
▸ MAPT P10636 4/20 0.39
▸ MEN1 O00255 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ HPGD P15428 2/20 0.39
▸ ABCG2 Q9UNQ0 2/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ ATM Q13315 1/20 0.39

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
SCHEMBL12305117 0.83 CYP2A6 (0.47) L3MBTL1CYP1A2KDRNPC1RAB9A
SCHEMBL19762181 0.80 L3MBTL1 (0.52) L3MBTL1LMNACYP1A2NPC1RAB9A
SCHEMBL19762101 0.79 L3MBTL1 (0.50) L3MBTL1LMNACYP1A2RAB9AMAPT
SCHEMBL19762167 0.79 L3MBTL1 (0.50) L3MBTL1LMNACYP1A2RAB9AMAPT
SCHEMBL19762133 0.79 L3MBTL1 (0.50) L3MBTL1LMNACYP1A2RAB9AMAPT
SCHEMBL19762129 0.79 L3MBTL1 (0.50) L3MBTL1LMNACYP1A2RAB9AMAPT
SCHEMBL21742662 0.78 L3MBTL1 (0.53) L3MBTL1LMNACYP1A2KDRNPC1
SCHEMBL21982357 0.78 GRM4 (0.48) L3MBTL1LMNACYP1A2ABL1ATM
SCHEMBL19762102 0.78 L3MBTL1 (0.48) L3MBTL1LMNACYP1A2MAPTMEN1
SCHEMBL19762156 0.78 L3MBTL1 (0.48) L3MBTL1LMNACYP1A2MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2020085319-A1 CYCLIC AZINE COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ELECTRON TRANSPORT MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, AND ORGANIC ELECTROLUMINESCENT ELEMENT 東ソー株式会社 2020-04-30 — — WO disclosed
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