SCHEMBL10242970

SCHEMBL10242970

CCNC(=O)OCc1cccc(Br)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.54
HCAR2 Q8TDS4 1/20 0.54
MMP1 P03956 1/20 0.53
MMP2 P08253 1/20 0.53
MMP9 P14780 1/20 0.53
MMP12 P39900 1/20 0.53
KDM4E B2RXH2 1/20 0.52
MAPK1 P28482 1/20 0.52
CYP1A2 P05177 2/20 0.52
CYP2C19 P33261 2/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2D6 P10635 1/20 0.52
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50
MAOB P27338 5/20 0.49
IDO1 P14902 2/20 0.47
AGXT P21549 2/20 0.47
HSP90AA1 P07900 1/20 0.47
SLC6A19 Q695T7 1/20 0.47
MAOA P21397 1/20 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
SCHEMBL3151323 0.84 HCAR2 (0.56) GLAHCAR2MMP1MMP2MMP9
SCHEMBL14233717 0.83 LMNA (0.45)
SCHEMBL10243039 0.82 LMNA (0.44)
SCHEMBL25852781 0.82 HCAR2 (0.54) HCAR2MMP1MMP2MMP9MMP12
SCHEMBL28168490 0.81 HCAR2 (0.56) GLAHCAR2MMP1MMP2MMP9
SCHEMBL13735763 0.81 HTT (0.59) GLAHCAR2MMP1MMP2MMP9
SCHEMBL27574865 0.81 GLA (0.53) GLAHCAR2MMP1MMP2MMP9
SCHEMBL5943754 0.81 GLA (0.56) GLAHCAR2MMP1MMP2MMP9
SCHEMBL137308 0.80 LMNA (0.65)
SCHEMBL14233691 0.79 SMN1; SMN2 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114605301-B Method for preparing Pa Luo Weide intermediate 江苏恒沛药物科技有限公司 2024-06-04 CN claimed
CN-114605301-A Method for preparing intermediate of palovir 江苏恒沛药物科技有限公司 2022-06-10 CN claimed
CN-114605301-B Method for preparing Pa Luo Weide intermediate 江苏恒沛药物科技有限公司 2024-06-04 CN disclosed
WO-2023184898-A1 BIFUNCTIONAL COMPOUND FOR SIMULTANEOUSLY REGULATING BTK AND IKZF3 水木未来(北京)科技有限公司 2023-10-05 WO disclosed
CN-116462664-A Pyrazole ring compound, preparation method, composition and application thereof 上海赛默罗生物科技有限公司 2023-07-21 CN disclosed
CN-115626949-A BET protein targeted degradation compound and preparation method and application thereof 南京澳健生物制药有限公司 2023-01-20 CN disclosed
CN-114605301-A Method for preparing intermediate of palovir 江苏恒沛药物科技有限公司 2022-06-10 CN disclosed
CN-114409658-B Bifunctional compound capable of simultaneously regulating BTK and IKZF3 水木未来(北京)科技有限公司 2022-06-07 CN disclosed
CN-114409658-A Bifunctional compound capable of simultaneously regulating BTK and IKZF3 水木未来(北京)科技有限公司 2022-04-29 CN disclosed
CN-111233758-B PSMA inhibitor, application thereof and nuclear species imaging reagent targeting PSMA 北京大学第一医院 2021-04-23 CN disclosed
CN-111233758-A PSMA inhibitor, application thereof and nuclear species imaging reagent targeting PSMA 北京大学第一医院 2020-06-05 CN disclosed
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-8097708-B2 10a-Azalide compound TAISHO PHARMACEUTICAL CO., LTD. (JP) 2012-01-17 US disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US disclosed
US-20090281292-A1 10a-Azalide Compound MEIJI SEIKA PHARMA CO., LTD. (JP) 2009-11-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090281292-A1 10a-Azalide Compound IL17A, AZI2, HDAC9 GLA 141/4885HCAR2 2195/4885MMP1 266/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.