SCHEMBL21769573

SCHEMBL21769573

Cc1ccc(N(CC(=O)Nc2ccc(-c3ncon3)cc2)C(=O)C2CCSCC2)cc1Cl

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 4/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ MAPT P10636 5/20 0.36
▸ TP53 P04637 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ RAB9A P51151 2/20 0.34
▸ THRB P10828 2/20 0.34
▸ USP2 O75604 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ MEN1 O00255 2/20 0.34
▸ KMT2A Q03164 2/20 0.34
▸ TSHR P16473 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33

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
SCHEMBL17923449 0.93 SMN1; SMN2 (0.36) POLBL3MBTL1ATMMAPTSMN1; SMN2
SCHEMBL21769854 0.91 KMT2A (0.39) POLBL3MBTL1ATMMAPTRAB9A
SCHEMBL17923453 0.91 MAPT (0.35) L3MBTL1MAPTTP53THRBMEN1
SCHEMBL21769572 0.89 POLB (0.38) POLBL3MBTL1ATMMAPTTP53
SCHEMBL21769740 0.89 L3MBTL1 (0.33) L3MBTL1ATMMAPTTP53SMN1; SMN2
SCHEMBL17923455 0.89 MAPT (0.37) L3MBTL1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL21769874 0.88 MAPT (0.38) L3MBTL1MAPTSMN1; SMN2RAB9AHTT
SCHEMBL21769731 0.88 KMT2A (0.40) POLBMAPTSMN1; SMN2RAB9AUSP2
SCHEMBL21769885 0.86 POLB (0.37) POLBMAPTSMN1; SMN2RAB9ANPC1
SCHEMBL6011837 0.85 ALDH1A1 (0.36) POLBL3MBTL1ATMMAPTSMN1; SMN2

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-2020038812-A1 NEW PROCESS FOR THE PREPARATION OF AMENAMEVIR RIJKSUNIVERSITEIT GRONINGEN (NL) 2020-02-27 — — WO disclosed
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