SCHEMBL30450130

SCHEMBL30450130

CC(C)(C)OC(=O)Nc1nc2ccc(Nc3cncc(F)c3)cc2s1.Nc1nc2ccc(Nc3ccnc(F)c3)cc2s1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LCK P06239 9/20 0.42
PIK3CG P48736 1/20 0.41
P2RX3 P56373 2/20 0.38
KMT2A Q03164 1/20 0.37
PIK3CA P42336 1/20 0.37
PDPK1 O15530 1/20 0.37
DYRK1A Q13627 1/20 0.37
EPHX2 P34913 1/20 0.36

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
SCHEMBL25305115 0.88 LCK (0.51) LCKPIK3CGP2RX3KMT2APDPK1
SCHEMBL31114539 0.88 LCK (0.52) LCKP2RX3KMT2APDPK1DYRK1A
SCHEMBL25303173 0.88 LCK (0.52) LCKP2RX3KMT2APDPK1DYRK1A
SCHEMBL30450911 0.83 LCK (0.46) LCKPIK3CADYRK1AEPHX2
SCHEMBL30451627 0.82 LCK (0.49) LCKPIK3CGKMT2AEPHX2
SCHEMBL30451439 0.81 LCK (0.46) LCKP2RX3KMT2APIK3CAPDPK1
SCHEMBL30450350 0.79 LCK (0.51) LCKKMT2APDPK1DYRK1AEPHX2
SCHEMBL25259089 0.78 PIK3CD (0.50) LCKDYRK1A
SCHEMBL31114491 0.78 PIK3CD (0.50) LCKDYRK1A
SCHEMBL25260578 0.77 LCK (0.50) LCKDYRK1A

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
EP-4460500-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE - INSERM (FR) 2024-11-13 EP disclosed
WO-2023131649-A1 BENZOTHIAZOLE ANAOLOGUES AND USE THEREOF AS BOOSTERS OF ANTI TUBERCULOSIS DRUGS INSTITUT NATIONAL DE LA SANTE ET DE LA RECHERCHE MEDICALE (INSERM) (FR) 2023-07-13 WO disclosed