SCHEMBL1282142

SCHEMBL1282142

NCC(=CF)COc1cccc2ccccc12

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AOC2 O75106 4/20 0.64
MAOA P21397 4/20 0.64
MAOB P27338 4/20 0.64
DAO P14920 2/20 0.58
KDM4E B2RXH2 2/20 0.54
ALDH1A1 P00352 1/20 0.54
HPGD P15428 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
NR2E1 Q9Y466 2/20 0.54
HTR1B P28222 2/20 0.53
OGG1 O15527 1/20 0.52
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
TSHR P16473 1/20 0.47
AOC3 Q16853 5/20 0.46

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
SCHEMBL1282141 1.00 AOC2 (0.64) AOC2MAOAMAOBDAOKDM4E
SCHEMBL29483377 1.00 AOC2 (0.64) AOC2MAOAMAOBDAOKDM4E
SCHEMBL9468858 0.85 KDM4E (0.54) AOC2MAOAMAOBKDM4EALDH1A1
SCHEMBL9468859 0.85 KDM4E (0.54) AOC2MAOAMAOBKDM4EALDH1A1
SCHEMBL9468614 0.85 KDM4E (0.54) AOC2MAOAMAOBKDM4EALDH1A1
SCHEMBL3505391 0.78 AOC2 (0.68) AOC2MAOAMAOBDAOKDM4E
SCHEMBL8248653 0.76 MAOB (0.60) AOC2MAOAMAOBDAOALDH1A1
SCHEMBL24147679 0.75 MAOA (0.62) AOC2MAOAMAOBDAOKDM4E
SCHEMBL3505446 0.75 MAOB (0.62) AOC2MAOAMAOBDAOAOC3
SCHEMBL9468678 0.74 AOC2 (0.69) AOC2MAOAMAOBDAOAOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5252608-A Preventing the abnormal deposition of collagen by administering a halogenated allyl amines MERRELL DOW PHARMACEUTICALS INC. (US) 1993-10-12 US claimed
CN-118324767-A Diacylglycerol kinase modulating compounds 卡尔那生物科学株式会社 2024-07-12 CN disclosed
CN-113227089-B Substituted 6-azabenzimidazole compounds as HPK1 inhibitors 吉利德科学公司 2024-07-05 CN disclosed
CN-113773387-B PD-L1 antibodies and uses thereof 天境生物科技(上海)有限公司 2024-06-21 CN disclosed
CN-118221646-A PD-1/PD-L1 inhibitors 吉利德科学公司 2024-06-21 CN disclosed
CN-118201941-A CD73 compounds 吉利德科学公司 2024-06-14 CN disclosed
CN-118178645-A Combination therapy for the treatment of myelodysplastic syndrome and acute myeloid leukemia 四十七公司 2024-06-14 CN disclosed
CN-118139858-A Pyrazin-3 (2H) -one derivatives 吉利德科学公司 2024-06-04 CN disclosed
CN-118084940-A PD-1/PD-L1 inhibitors 吉利德科学公司 2024-05-28 CN disclosed
CN-117964757-A Antibodies and fusion proteins that bind CCR8 and uses thereof 吉利德科学公司 2024-05-03 CN disclosed
EP-2185198-A1 LOX AND L0XL2 INHIBITORS AND USES THEREOF Arresto Biosciences, Inc. (US) 2010-05-19 EP disclosed
EP-2182981-A2 METHODS AND COMPOSITIONS FOR TREATMENT AND DIAGNOSIS OF FIBROSIS, TUMOR INVASION, ANGIOGENESIS, AND METASTASIS Arresto Biosciences, Inc. (US) 2010-05-12 EP disclosed
CN-101489394-A Methods and compositions for the in vivo treatment and prevention of tumor metastasis UNIV LELAND STANFORD JUNIOR (US) 2009-07-22 CN disclosed
US-20090104201-A1 METHODS AND COMPOSITIONS FOR TREATMENT AND DIAGNOSIS OF FIBROSIS, TUMOR INVASION, ANGIOGENESIS, AND METASTASIS GILEAD BIOLOGICS, INC. 2009-04-23 US disclosed
WO-2009035791-A1 LOX AND L0XL2 INHIBITORS AND USES THEREOF ARRESTO BIOSCIENCES (US) 2009-03-19 WO disclosed
WO-2009017833-A2 METHODS AND COMPOSITIONS FOR TREATMENT AND DIAGNOSIS OF FIBROSIS, TUMOR INVASION, ANGIOGENESIS, AND METASTASIS ARRESTO BIOSCIENCES (US) 2009-02-05 WO disclosed
EP-2010224-A2 METHOD AND COMPOSITION FOR TREATING AND PREVENTING TUMOR METASTASIS IN VIVO The Board of Trustees of The Leland Stanford Junior University (US) 2009-01-07 EP disclosed
WO-2007126457-A2 METHOD AND COMPOSITION FOR TREATING AND PREVENTING TUMOR METASTASIS IN VIVO THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) 2007-11-08 WO disclosed
US-20070225242-A1 Method and composition for treating and preventing tumor metastasis in vivo THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2007-09-27 US disclosed
US-20070021365-A1 Inhibition of Lysyl oxidase for treating tumor growth and diagnostics relating thereto THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY 2007-01-25 US disclosed