SCHEMBL9776965

SCHEMBL9776965

CCNc1nc2ccc(OC(F)(F)F)cc2s1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.65
▸ RAB9A P51151 5/20 0.58
▸ NPC1 O15118 4/20 0.58
▸ SMN1; SMN2 Q16637 4/20 0.58
▸ SCN4A P35499 2/20 0.58
▸ SCN9A Q15858 2/20 0.58
▸ HSD17B10 Q99714 2/20 0.58
▸ CYP1A2 P05177 2/20 0.58
▸ GMNN O75496 1/20 0.58
▸ USP2 O75604 1/20 0.58
▸ LMNA P02545 1/20 0.58
▸ TP53 P04637 1/20 0.58
▸ CYP3A4 P08684 1/20 0.58
▸ ADORA3 P0DMS8 1/20 0.58
▸ GAA P10253 1/20 0.58
▸ CYP2C9 P11712 1/20 0.58
▸ PKM P14618 1/20 0.58
▸ ALOX15 P16050 1/20 0.58
▸ NFKB1 P19838 1/20 0.58
▸ SLC6A2 P23975 1/20 0.58

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
SCHEMBL27834217 0.87 DYRK1A (0.60) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A
SCHEMBL6250112 0.86 DYRK1A (0.61) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A
SCHEMBL6254947 0.85 DYRK1A (0.60) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A
Hydrochloric Acid SCHEMBL6834656 0.85 DYRK1A (0.60) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A
SCHEMBL9776980 0.85 DYRK1A (0.70) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A
Hydrochloric Acid SCHEMBL6253890 0.84 DYRK1A (0.59) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A
SCHEMBL22436025 0.83 DYRK1A (0.61) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A
SCHEMBL2759560 0.83 RAB9A (0.65) DYRK1ARAB9ANPC1SMN1; SMN2CYP1A2
SCHEMBL2116986 0.83 NPC1 (0.68) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A
SCHEMBL19850784 0.82 DYRK1A (0.67) DYRK1ARAB9ANPC1SMN1; SMN2SCN4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107007598-A 2‑(N ethyls)6 trifluoromethoxy benzo thiazoles as cancer therapy drug application 西北工业大学 2017-08-04 — — CN claimed
CN-107007598-B 2- (N- ethyl) -6- trifluoromethoxy benzo thiazole is preparing the application in anticancer drug 西北工业大学 2019-06-21 — — CN disclosed
CN-107007598-A 2‑(N ethyls)6 trifluoromethoxy benzo thiazoles as cancer therapy drug application 西北工业大学 2017-08-04 — — CN disclosed
US-5068238-A Anticonvulsants, schizophrenia, sleep disorders, antiischemia agents and cognition activators RHONE-POULENC SANTE (FR) 1991-11-26 — — US disclosed
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