SCHEMBL19622826

SCHEMBL19622826

C1=C(c2cccc(-c3ccccc3)c2)NC(c2cccc(-c3ccccc3)c2)NC1c1cccc(-c2cccc(-c3ncccn3)c2)c1

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CLK4 Q9HAZ1 2/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ GP6 Q9HCN6 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ TNKS2 Q9H2K2 1/20 0.31
▸ NISCH Q9Y2I1 1/20 0.31
▸ HPGD P15428 1/20 0.30
▸ HDAC4 P56524 2/20 0.30
▸ HDAC3 O15379 1/20 0.30
▸ HDAC7 Q8WUI4 1/20 0.30
▸ HDAC8 Q9BY41 1/20 0.30
▸ HDAC6 Q9UBN7 1/20 0.30
▸ HDAC9 Q9UKV0 1/20 0.30
▸ HDAC5 Q9UQL6 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
SCHEMBL17725990 0.84 KDM4E (0.33) ALDH1A1KDM4EMAPTHPGD
SCHEMBL20733760 0.83 ALDH1A1 (0.37) ALDH1A1KDM4EMAPTHPGD
SCHEMBL23511331 0.80 — —
SCHEMBL18731829 0.80 GAA (0.41) ALDH1A1KDM4EMAPTHPGD
SCHEMBL22428525 0.79 NOTUM (0.38) NISCH
SCHEMBL18786354 0.76 CYP1A2 (0.40) ALDH1A1MAPTTNKS2HPGD
SCHEMBL25930102 0.76 KDM4E (0.36) ALDH1A1KDM4EHPGDHDAC4
SCHEMBL27337735 0.76 — —
SCHEMBL18786340 0.76 GAA (0.39) ALDH1A1KDM4EMAPTHPGD
SCHEMBL23511329 0.74 PTPN1 (0.30) —

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
EP-3246963-A2 ORGANIC LIGHT-EMITTING DEVICE Samsung Display Co., Ltd. (KR) 2017-11-22 — — EP disclosed
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