SCHEMBL4179729

SCHEMBL4179729

Cc1cccc(OC#N)c1

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.56
LMNA P02545 2/20 0.52
AR P10275 3/20 0.47
ALDH1A1 P00352 3/20 0.46
GAA P10253 1/20 0.43
HTT P42858 2/20 0.41
MAPT P10636 2/20 0.41
KMT2A Q03164 1/20 0.41
CRHR1 P34998 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
SLC6A2 P23975 1/20 0.39
SLC6A4 P31645 1/20 0.39
SLC6A3 Q01959 1/20 0.39
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
ALOX5 P09917 1/20 0.38

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
SCHEMBL26009 0.84 KMT2A (0.41) ACHELMNAARALDH1A1GAA
SCHEMBL15421219 0.83 ACHE (0.56) ACHELMNAARALDH1A1GAA
SCHEMBL19808928 0.79 KMT2A (0.38) ACHELMNAARALDH1A1GAA
SCHEMBL28392645 0.79 ACHE (0.52) ACHELMNAARALDH1A1GAA
SCHEMBL98118 0.78 ACHE (0.56) ACHELMNAARALDH1A1GAA
SCHEMBL11849487 0.78 ACHE (0.50) ACHELMNAALDH1A1
SCHEMBL12916666 0.78 ACHE (0.56) ACHELMNAARALDH1A1GAA
SCHEMBL11032757 0.77 MEN1 (0.46) LMNAARALDH1A1GAAHTT
SCHEMBL9280504 0.77 ACHE (0.54) ACHELMNAARALDH1A1GAA
SCHEMBL17042459 0.77 CYP2A6 (0.54) ACHELMNAARALDH1A1GAA

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 100 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528477-B1 Toughened thermoplastic compositions based on polyphenylene ether and polyamide ENICHEM SPA (IT) 1997-05-21 EP claimed
CN-118251445-A Cyclic organosiloxane containing imide bond and polymerizable unsaturated bond and curable resin composition containing the same 信越化学工业株式会社 2024-06-25 CN disclosed
CN-118043384-A Prepreg, laminate and printed circuit board 三菱瓦斯化学株式会社 2024-05-14 CN disclosed
CN-112236464-B Resin composition, prepreg, metal foil-clad laminate, resin sheet, and printed wiring board 三菱瓦斯化学株式会社 2024-02-23 CN disclosed
CN-117529509-A Resin composition, resin sheet, multilayer printed wiring board, and semiconductor device 三菱瓦斯化学株式会社 2024-02-06 CN disclosed
CN-117500850-A Resin composition, resin sheet, multilayer printed wiring board, and semiconductor device 三菱瓦斯化学株式会社 2024-02-02 CN disclosed
CN-117500851-A Resin composition, resin sheet, multilayer printed wiring board, and semiconductor device 三菱瓦斯化学株式会社 2024-02-02 CN disclosed
US-20240016699-A1 PHARMACEUTICAL PACKAGES WITH COATINGS COMPRISING POLYCYANURATES CORNING INC (US) 2024-01-18 US disclosed
CN-117355545-A Resin composition, resin sheet, multilayer printed wiring board, and semiconductor device 三菱瓦斯化学株式会社 2024-01-05 CN disclosed
CN-117222682-A Cured resin composition and cured product thereof 日本化药株式会社 2023-12-12 CN disclosed
US-4727169-A ANTIULCER AGENTS RORER PHARMACEUTICAL CORPORATION (US) 1988-02-23 US disclosed
EP-0253166-A2 1,4-Piperazine derivatives, process for their preparation, their use and therapeutical agent containing them HEUMANN PHARMA GMBH & CO (DE) 1988-01-20 EP disclosed
US-4704388-A ANTIULCER, CYTOPROTECTIVE RORER PHARMACEUTICAL CORPORATION (US) 1987-11-03 US disclosed
EP-0185684-A4 3- AND 5- ADBICYCLIC ETHER OR BICYCLIC ALKYLENE THIOETHER BDALKYLENE AMINO THIATRIAZINES, AND THEIR PHARMACEUTICAL USES. RORER INTERNAT OVERSEAS INC (US) 1986-09-22 EP disclosed
EP-0185684-A1 3- AND 5- ADBICYCLIC ETHER OR BICYCLIC ALKYLENE THIOETHER BDALKYLENE AMINO THIATRIAZINES, AND THEIR PHARMACEUTICAL USES RORER INTERNATIONAL (OVERSEAS) INC. (a Delaware corporation) (US) 1986-07-02 EP disclosed
US-4595683-A Gastrointestinal disorders, antiulcer agents WILLIAM H. RORER, INC. (US) 1986-06-17 US disclosed
WO-1985005105-A1 3- AND 5- ADBICYCLIC ETHER OR BICYCLIC ALKYLENE THIOETHER BDALKYLENE AMINO THIATRIAZINES, AND THEIR PHARMACEUTICAL USES RORER INTERNATIONAL (OVERSEAS) INC. (US) 1985-11-21 WO disclosed
US-4166860-A TREATMENT OF ACHLORHYDRIA AND DYSMENORRHEA WILLIAM H. RORER, INC. (US) 1979-09-04 US disclosed
US-3994949-A REACTION OF PHENOLATE WITH CYANOGEN HALIDE, TERT-AMINE CATALYST BAYER AKTIENGESELLSCHAFT (DT) 1976-11-30 US disclosed
US-3956307-A FUNGICIDES SCHERING AKTIENGESELLSCHAFT (DT) 1976-05-11 US disclosed