SCHEMBL840872

SCHEMBL840872

Cc1c(N)cccc1Cc1cccc(N)c1C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.62
TSHR P16473 2/20 0.62
PIK3CA P42336 1/20 0.62
ALDH1A1 P00352 5/20 0.50
ESR1 P03372 1/20 0.42
KCNH2 Q12809 1/20 0.42
CD44 P16070 1/20 0.42
HSD17B10 Q99714 2/20 0.39
ALOX15 P16050 2/20 0.39
CASP7 P55210 2/20 0.39
CYP1A2 P05177 1/20 0.39
HIF1A Q16665 1/20 0.39
TDP1 Q9NUW8 2/20 0.39
HPGD P15428 3/20 0.38
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
CASP1 P29466 1/20 0.36
CCNE2 O96020 1/20 0.34
CCNE1 P24864 1/20 0.34

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
SCHEMBL2780244 0.93 CYP3A4 (0.54) CYP3A4TSHRPIK3CAALDH1A1ESR1
SCHEMBL9800610 0.86 CYP3A4 (0.64) CYP3A4TSHRPIK3CAALDH1A1ESR1
SCHEMBL10891857 0.85 CYP3A4 (0.50) CYP3A4TSHRPIK3CAALDH1A1CD44
SCHEMBL10508078 0.83 CYP3A4 (0.48) CYP3A4TSHRPIK3CAALDH1A1ESR1
SCHEMBL5929976 0.83 CYP3A4 (0.59) CYP3A4TSHRPIK3CAALDH1A1ESR1
SCHEMBL7406902 0.83 CYP3A4 (0.59) CYP3A4TSHRPIK3CAALDH1A1ESR1
SCHEMBL25259982 0.81 CYP3A4 (0.56) CYP3A4TSHRPIK3CAALDH1A1ESR1
SCHEMBL30990676 0.81 CYP3A4 (0.56) CYP3A4TSHRPIK3CAALDH1A1ESR1
Hydrochloric Acid SCHEMBL14994099 0.81 CYP3A4 (0.56) CYP3A4TSHRPIK3CAALDH1A1ESR1
SCHEMBL30283155 0.81 CYP3A4 (0.56) CYP3A4TSHRPIK3CAALDH1A1ESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110885443-B Thermoplastic polyimide and preparation method thereof 万华化学集团股份有限公司 2022-04-22 CN claimed
CN-109627763-B Method for preparing polyimide molding powder by solid-phase polymerization 万华化学集团股份有限公司 2022-02-18 CN claimed
CN-110885443-A Thermoplastic polyimide and preparation method thereof 万华化学集团股份有限公司 2020-03-17 CN claimed
EP-1694478-B1 WOOD-TREATMENT METHOD COMPRISING IN SITU POLYMERISATION UNDER ELECTROMAGNETIC RADIATION HENRI SELMER PARIS (FR) 2008-03-05 EP claimed
JP-2007513807-A 2007-05-31 JP claimed
EP-1694478-A1 WOOD-TREATMENT METHOD COMPRISING IN SITU POLYMERISATION UNDER ELECTROMAGNETIC RADIATION Henri Selmer Paris (FR) 2006-08-30 EP claimed
WO-2005065901-A1 WOOD-TREATMENT METHOD COMPRISING IN SITU POLYMERISATION UNDER ELECTROMAGNETIC RADIATION HENRI SELMER PARIS (FR) 2005-07-21 WO claimed
EP-0583958-B1 Polyimide/aliphatic polyester copolymers EXXON RESEARCH ENGINEERING CO (US) 1996-10-02 EP claimed
CN-118956309-A Underfill adhesive, and preparation method and application thereof 韦尔通科技股份有限公司 2024-11-15 CN disclosed
CN-110520433-B Phosphorus-containing phenol compound, phosphorus-containing epoxy resin, curable resin composition or epoxy resin composition, and cured product thereof 日铁化学材料株式会社 2023-12-05 CN disclosed
EP-3620459-B9 PHOSPHORUS-CONTAINING PHENOLIC COMPOUND, PHOSPHORUS-CONTAINING EPOXY RESIN, CURABLE RESIN COMPOSITION THEREOF, OR EPOXY RESIN COMPOSITION AND CURED PRODUCT THEREOF NIPPON STEEL CHEMICAL & MAT CO LTD (JP) 2023-10-04 EP disclosed
EP-3133108-B1 FIBER-REINFORCED COMPOSITE MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2023-08-02 EP disclosed
EP-3620459-B1 PHOSPHORUS-CONTAINING PHENOLIC COMPOUND, PHOSPHORUS-CONTAINING EPOXY RESIN, CURABLE RESIN COMPOSITION THEREOF, OR EPOXY RESIN COMPOSITION AND CURED PRODUCT THEREOF NIPPON STEEL CHEMICAL & MAT CO LTD (JP) 2023-05-24 EP disclosed
EP-3620459-A1 PHOSPHORUS-CONTAINING PHENOLIC COMPOUND, PHOSPHORUS-CONTAINING EPOXY RESIN, CURABLE RESIN COMPOSITION THEREOF, OR EPOXY RESIN COMPOSITION AND CURED PRODUCT THEREOF NIPPON STEEL Chemical & Material Co., Ltd. (JP) 2020-03-11 EP disclosed
EP-0329456-B1 Expoxy resin curing agent of a two-component type TOA NENRYO KOGYO KK (JP) 1994-06-01 EP disclosed
US-5091474-A EPOXY RESIN CURING AGENT BASED ON BLENDS CONTAINING DISECONDARY AROMATIC DIAMINES TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) 1992-02-25 US disclosed
EP-0329456-A1 Expoxy resin curing agent of a two-component type TOA NENRYO KOGYO KABUSHIKI KAISHA (JP) 1989-08-23 EP disclosed
US-4784814-A TEMPERATURE GRADIENT CIBA-GEIGY CORPORATION (US) 1988-11-15 US disclosed
EP-0208654-B1 REACTION TRANSFER MOULDING PROCESS AND APPARATUS FOR THE PRODUCTION OF MOULDINGS OF THERMOSETTING MATERIALS WHICH MAY CONTAIN FILLERS AND/OR REINFORCING MATERIALS CIBA-GEIGY AG (CH) 1988-10-05 EP disclosed
EP-0208654-A1 Reaction transfer moulding process and apparatus for the production of mouldings of thermosetting materials which may contain fillers and/or reinforcing materials CIBA-GEIGY AG (CH) 1987-01-14 EP disclosed