SCHEMBL476573

SCHEMBL476573

C=CCNc1ccc(N)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 3/20 0.60
CA1 P00915 3/20 0.60
CA2 P00918 3/20 0.60
CA9 Q16790 3/20 0.60
APP P05067 1/20 0.43
MAPT P10636 5/20 0.41
RAB9A P51151 2/20 0.41
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39
RRM2 P31350 1/20 0.39
ALDH1A1 P00352 2/20 0.38
CYP2C19 P33261 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX12 P18054 1/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 5/20 0.38
MEN1 O00255 4/20 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
SCHEMBL4921793 0.94 CA12 (0.55) CA12CA1CA2CA9APP
SCHEMBL5958592 0.90 ALDH1A1 (0.52) CA12CA1CA2CA9APP
SCHEMBL2820178 0.90 CA12 (0.51) CA12CA1CA2CA9APP
SCHEMBL461866 0.90 CA12 (0.51) CA12CA1CA2CA9APP
Hydrochloric Acid SCHEMBL10483019 0.89 CA12 (0.50) CA12CA1CA2CA9APP
SCHEMBL99646 0.88 CA12 (0.65) CA12CA1CA2CA9MAPT
Tromethamine SCHEMBL2355478 0.86 CA12 (0.47) CA12CA1CA2CA9APP
SCHEMBL14672034 0.82 APP (0.45) CA12CA1CA2CA9APP
SCHEMBL1585896 0.81 CA12 (0.59) CA12CA1CA2CA9MAPT
Tromethamine SCHEMBL461865 0.79 CA12 (0.42) CA12CA1CA2CA9APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114539074-B Refining method of N-alkyl-p-phenylenediamine 山东阳谷华泰化工股份有限公司 2024-06-11 CN claimed
CN-114129727-B Boron nanosheet composite material and preparation method thereof 大连理工大学 2022-09-27 CN claimed
CN-114933540-A Preparation method and application of novel acid-binding agent 东南大学 2022-08-23 CN claimed
CN-113980357-B Functionalized graphene, preparation method thereof and application of functionalized graphene in rubber base plate 河北铁科翼辰新材科技有限公司 2022-03-18 CN claimed
CN-114129727-A Boron nanosheet composite material and preparation method thereof 大连理工大学 2022-03-04 CN claimed
CN-113980357-A Functionalized graphene, preparation method thereof and application of functionalized graphene in rubber base plate 河北铁科翼辰新材科技有限公司 2022-01-28 CN claimed
CN-113511952-A Polymerization inhibitor for preventing alpha olefin polymerization and use method thereof 碳氢联合科技(北京)有限公司 2021-10-19 CN claimed
CN-109852445-B Environment-friendly vehicle gasoline component for replacing MTBE 中国标准化研究院 2021-10-08 CN claimed
CN-109852445-A Environment-friendly vehicle gasoline component for replacing MTBE 中国标准化研究院 2019-06-07 CN claimed
US-20120248378-A1 Substituted Triazine Compositions and Methods for Producing Same ADDIVANT USA, LLC 2012-10-04 US claimed
JP-2009540100-A 2009-11-19 JP claimed
EP-2029704-A1 ANTIOXIDANT ADDITIVE FOR BIODIESEL FUELS CHEMTURA CORPORATION (US) 2009-03-04 EP claimed
WO-2007145738-A1 ANTIOXIDANT ADDITIVE FOR BIODIESEL FUELS CHEMTURA CORPORATION (US) 2007-12-21 WO claimed
WO-2003078537-A2 CURE ACCELERATORS FOR ANAEROBIC ADHESIVE COMPOSITIONS HENKEL CORPORATION (US) 2003-09-25 WO claimed
EP-0495228-B1 Substituted polyamide-imides BASF AG (DE) 1995-03-22 EP claimed
EP-0305190-B1 Arylenedoamino substituted triazine UNIROYAL CHEM CO INC (US) 1994-03-30 EP claimed
US-5229484-A N-SUBSTITUTED POLYAMIDE-IMIDE BASF AKTIENGESELLSCHAFT (DE) 1993-07-20 US claimed
WO-1991005773-A1 N-ALKYL-P-QUINONEDIIMINO TRIAZINE COMPOUNDS UNIROYAL CHEMICAL COMPANY, INC. (US) 1991-05-02 WO claimed
EP-0305190-A2 Arylenedoamino substituted triazine UNIROYAL CHEMICAL COMPANY, Inc. (US) 1989-03-01 EP claimed
US-4738917-A HIGH SPEED KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) 1988-04-19 US claimed