SCHEMBL21709326

SCHEMBL21709326

c1ccc(-n2c3ccccc3c3cc(-c4cc5c6ccccc6[nH]c5c5c4sc4ccccc45)ccc32)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ MAP3K9 P80192 3/20 0.37
▸ MAP3K11 Q16584 3/20 0.37
▸ CDK4 P11802 1/20 0.37
▸ CCND1 P24385 1/20 0.37
▸ TNKS O95271 2/20 0.37
▸ TNKS2 Q9H2K2 2/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ ATM Q13315 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ NTRK1 P04629 1/20 0.34
▸ MAP3K10 Q02779 1/20 0.34
▸ ALOX5 P09917 1/20 0.33
▸ PDE7A Q13946 2/20 0.31
▸ PDE7B Q9NP56 2/20 0.31
▸ PTGER4 P35408 1/20 0.31
▸ HPGD P15428 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
SCHEMBL21707207 0.87 MEN1 (0.38) MEN1MAPTRAB9AKMT2AMAP3K9
SCHEMBL19933770 0.83 ATM (0.42) MEN1MAPTKMT2AKDM4EATM
SCHEMBL21709347 0.82 TNKS (0.40) MEN1MAPTRAB9AKMT2AMAP3K9
SCHEMBL15860203 0.82 L3MBTL1 (0.46) MEN1KMT2AKDM4EATML3MBTL1
SCHEMBL19784922 0.82 MEN1 (0.38) MEN1MAPTRAB9AKMT2AMAP3K9
SCHEMBL18132849 0.81 MEN1 (0.41) MEN1MAPTRAB9AKMT2AMAP3K9
SCHEMBL26444660 0.81 KDM4E (0.42) MEN1MAPTRAB9AKMT2ATNKS
SCHEMBL20175560 0.80 L3MBTL1 (0.39) MEN1MAPTKMT2ATNKSTNKS2
SCHEMBL20175674 0.80 L3MBTL1 (0.39) MEN1MAPTKMT2ATNKSTNKS2
SCHEMBL20175672 0.80 L3MBTL1 (0.39) MEN1MAPTKMT2ATNKSTNKS2

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
WO-2020032424-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING, AS HOST MATERIAL, MIXTURE OF DIFFERENT KINDS OF COMPOUNDS, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2020-02-13 — — WO disclosed
WO-2020032447-A1 ORGANIC ELECTRONIC ELEMENT COMPRISING, AS HOST MATERIAL, MIXTURE OF DIFFERENT KINDS OF COMPOUNDS, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2020-02-13 — — WO disclosed
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