SCHEMBL23028867

SCHEMBL23028867

Cc1nc(-c2ccccc2)c2sc3ccc4ccccc4c3c2n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ MAPK1 P28482 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ MMP14 P50281 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ NTRK1 P04629 1/20 0.35
▸ NTRK3 Q16288 1/20 0.35
▸ TSHR P16473 2/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CASP1 P29466 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ CASP7 P55210 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ HIF1A Q16665 1/20 0.34

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
SCHEMBL18853024 0.85 MEN1 (0.38) MAPTL3MBTL1MAPK1MEN1LMNA
SCHEMBL17305861 0.84 ALDH1A1 (0.41) MAPTL3MBTL1MAPK1MEN1LMNA
SCHEMBL18852778 0.83 MAPT (0.41) MAPTL3MBTL1MAPK1MEN1KMT2A
SCHEMBL19106330 0.83 MEN1 (0.43) MAPTL3MBTL1MAPK1MEN1LMNA
SCHEMBL18852905 0.83 MEN1 (0.40) MAPTL3MBTL1MAPK1MEN1LMNA
SCHEMBL18853028 0.83 MEN1 (0.40) MAPTL3MBTL1MAPK1MEN1LMNA
SCHEMBL19169895 0.81 TNKS (0.46) MAPTL3MBTL1MEN1KMT2ANPSR1
SCHEMBL18852881 0.80 CYP1A1 (0.36) MAPTL3MBTL1MAPK1MEN1LMNA
SCHEMBL18853006 0.80 CYP1A1 (0.36) MAPTL3MBTL1MAPK1MEN1LMNA
SCHEMBL19169897 0.79 TNKS (0.47) MAPTL3MBTL1TDP1ATMLIMK1

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-2021034089-A1 COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2021-02-25 — — WO disclosed
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