SCHEMBL20887499

SCHEMBL20887499

CC(=O)Nc1nc2ccc(-c3cc(O)ccc3C)cc2s1

nearest known ligand 0.72

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 6/20 0.72
▸ ABL1 P00519 4/20 0.72
▸ PDGFRA P16234 2/20 0.72
▸ KIT P10721 1/20 0.72
▸ PIK3CG P48736 5/20 0.62
▸ PIK3CA P42336 4/20 0.59
▸ MAP4K1 Q92918 1/20 0.57
▸ CYP3A4 P08684 2/20 0.57
▸ NPC1 O15118 1/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP2C9 P11712 1/20 0.56
▸ CYP2C19 P33261 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ FSCN1 Q16658 1/20 0.56
▸ PDPK1 O15530 1/20 0.56
▸ LCK P06239 1/20 0.56

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
SCHEMBL3804150 0.85 PIK3CG (0.80) DYRK1APIK3CGPIK3CACYP3A4NPC1
SCHEMBL10170616 0.85 DYRK1A (1.00) DYRK1APIK3CGPIK3CACYP3A4NPC1
SCHEMBL30593693 0.84 ABL1 (1.00) ABL1PDGFRAKIT
SCHEMBL20855238 0.84 ABL1 (1.00) ABL1PDGFRAKIT
SCHEMBL20855185 0.84 ABL1 (1.00) ABL1PDGFRAKIT
SCHEMBL29078597 0.84 ABL1 (1.00) ABL1PDGFRAKIT
SCHEMBL1621800 0.82 ABL1 (1.00) ABL1PDGFRAKITPIK3CGPIK3CA
SCHEMBL3716998 0.81 PIK3CG (0.79) DYRK1APIK3CGPIK3CACYP3A4NPC1
SCHEMBL20855132 0.79 ABL1 (1.00) ABL1PDGFRAKITPIK3CGRAB9A
SCHEMBL20887521 0.79 PIK3CG (0.70) DYRK1AABL1PDGFRAKITPIK3CG

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-2019070093-A1 BENZOTHIAZOL COMPOUNDS AND METHODS USING THE SAME FOR TREATING NEURODEGENERATIVE DISORDERS 1ST Biotherapeutics, Inc. (KR) 2019-04-11 — — WO disclosed
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