SCHEMBL27810285

SCHEMBL27810285

O=COCc1cccc2cccnc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.44
HTR5A P47898 3/20 0.44
MMP9 P14780 2/20 0.44
TSHR P16473 2/20 0.44
KDM4E B2RXH2 2/20 0.44
GMNN O75496 1/20 0.44
LMNA P02545 1/20 0.44
TP53 P04637 1/20 0.44
HSP90AA1 P07900 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
MAPT P10636 1/20 0.44
ALOX15 P16050 1/20 0.44
NFKB1 P19838 1/20 0.44
MMP8 P22894 1/20 0.44
CCR1 P32246 1/20 0.44
THPO P40225 1/20 0.44
MTOR P42345 1/20 0.44
HTT P42858 1/20 0.44
MMP13 P45452 1/20 0.44

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
SCHEMBL11003039 0.84 HDAC6 (0.46) MMP2HTR5AMMP9TSHRKDM4E
SCHEMBL27840246 0.81
SCHEMBL11318343 0.78 SRC (0.35) KDM4ECCR1HTTCCR5CCR8
SCHEMBL5459975 0.77 MAPT (0.48) MMP2MMP9TSHRKDM4EGMNN
SCHEMBL3145084 0.77 RAB9A (0.53) MMP2HTR5AMMP9TSHRKDM4E
SCHEMBL6225626 0.77 KDM4E (0.48) MMP2HTR5AMMP9TSHRKDM4E
SCHEMBL28317851 0.77 RET (0.35) MMP2MMP9LMNAMAPTHTT
SCHEMBL28707626 0.77 MMP2 (0.48) MMP2MMP9TSHRKDM4EGMNN
SCHEMBL16825440 0.77 KDM4E (0.44) MMP2HTR5AMMP9TSHRKDM4E
SCHEMBL27958707 0.77 KDM4E (0.44) KDM4ELMNACYP3A4MAPTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110270295-B Preparation method of amino-substituted benzopyridine nitrogen-containing heterocycle 北京六合宁远科技有限公司 2021-08-24 CN claimed
CN-110270295-A Preparation method of amino-substituted phenylpropylpyridine nitrogen-containing heterocycle 北京六合宁远科技有限公司 2019-09-24 CN claimed
CN-110270295-B Preparation method of amino-substituted benzopyridine nitrogen-containing heterocycle 北京六合宁远科技有限公司 2021-08-24 CN disclosed
CN-110270295-B Preparation method of amino-substituted benzopyridine nitrogen-containing heterocycle 北京六合宁远科技有限公司 2021-08-24 CN disclosed
CN-110270295-A Preparation method of amino-substituted phenylpropylpyridine nitrogen-containing heterocycle 北京六合宁远科技有限公司 2019-09-24 CN disclosed
CN-110270295-A Preparation method of amino-substituted phenylpropylpyridine nitrogen-containing heterocycle 北京六合宁远科技有限公司 2019-09-24 CN disclosed
CN-109562169-A anti-CD 98 antibodies and antibody drug conjugates 艾伯维公司 2019-04-02 CN disclosed
CN-109563167-A ANTI-B7-H3 ANTIBODIES AND ANTIBODY DRUG CONJUGATES 艾伯维公司 2019-04-02 CN disclosed
CN-109452288-A The composition and its method of administration for preventing and treating great Jiang bacterial wilt 王兴翠 2019-03-12 CN disclosed
CN-103958508-B Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases 艾伯维公司 2019-02-12 CN disclosed
CN-102083438-A Quenolines and related analogs as sirtuin modulators SIRTRIS PHARMACEUTICALS INC 2011-06-01 CN disclosed
CN-102036561-A Protein kinase modulators CYLENE PHARMACEUTICALS INC 2011-04-27 CN disclosed