SCHEMBL9333325

SCHEMBL9333325

CON(C(C)=O)c1nc2ccc(F)cc2s1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 1/20 0.52
▸ DYRK1A Q13627 1/20 0.52
▸ HTT P42858 5/20 0.49
▸ MAPT P10636 4/20 0.49
▸ KMT2A Q03164 4/20 0.49
▸ LMNA P02545 3/20 0.49
▸ HPGD P15428 3/20 0.49
▸ MEN1 O00255 3/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ SMN1; SMN2 Q16637 2/20 0.49
▸ TNF P01375 1/20 0.49
▸ GAA P10253 1/20 0.49
▸ NR2F2 P24468 1/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ KLF5 Q13887 1/20 0.49
▸ NOD1 Q9Y239 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.46
▸ NPC1 O15118 1/20 0.45
▸ USP2 O75604 1/20 0.45
▸ TP53 P04637 1/20 0.45

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
SCHEMBL25833305 0.88 PDPK1 (0.51) PDPK1DYRK1AHTTMAPTKMT2A
SCHEMBL9332923 0.80 TSHR (0.61) DYRK1AMAPTKMT2ALMNAHPGD
SCHEMBL9332418 0.80 TP53 (0.54) HTTMAPTKMT2ALMNAHPGD
SCHEMBL2588929 0.74 RAD52 (0.53) PDPK1DYRK1AHTTMAPTKMT2A
SCHEMBL6983750 0.72 DYRK1A (0.61) PDPK1DYRK1AHTTMAPTKMT2A
SCHEMBL25219141 0.71 MAPT (0.64) PDPK1DYRK1AHTTMAPTKMT2A
SCHEMBL30040343 0.71 MAPT (0.64) PDPK1DYRK1AHTTMAPTKMT2A
SCHEMBL9333296 0.70 NPC1 (0.50) DYRK1AHTTMAPTKMT2ALMNA
SCHEMBL15521825 0.69 DYRK1A (1.00) PDPK1DYRK1AHTTSMN1; SMN2NPC1
SCHEMBL16992946 0.69 ALDH1A1 (0.50) PDPK1DYRK1AHTTMAPTKMT2A

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0397169-B1 Novel benzothiazole derivatives TOYO BOSEKI (JP) 1994-04-13 — — EP claimed
US-5036086-A Novel benzothiazole derivatives TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-07-30 — — US claimed
EP-0397169-A1 Novel benzothiazole derivatives TOYO BOSEKI KABUSHIKI KAISHA Trading under the name of Toyobo Co., Ltd. (JP) 1990-11-14 — — EP claimed
EP-0397169-B1 Novel benzothiazole derivatives TOYO BOSEKI (JP) 1994-04-13 — — EP disclosed
US-5036086-A Novel benzothiazole derivatives TOYO BOSEKI KABUSHIKI KAISHA (JP) 1991-07-30 — — US disclosed
EP-0397169-A1 Novel benzothiazole derivatives TOYO BOSEKI KABUSHIKI KAISHA Trading under the name of Toyobo Co., Ltd. (JP) 1990-11-14 — — EP disclosed
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