SCHEMBL7542219

SCHEMBL7542219

Oc1ccc(N=Nc2cccc3ccccc23)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.54
GLO1 Q04760 1/20 0.51
L3MBTL1 Q9Y468 5/20 0.50
NPC1 O15118 4/20 0.50
MAPT P10636 4/20 0.50
KDM4E B2RXH2 3/20 0.50
MAPK1 P28482 2/20 0.50
IDO1 P14902 1/20 0.50
HSD17B10 Q99714 2/20 0.49
CYP2C9 P11712 1/20 0.49
TSHR P16473 1/20 0.49
PTPRA P18433 1/20 0.49
PTPRB P23467 1/20 0.49
CYP2C19 P33261 1/20 0.49
HIF1A Q16665 1/20 0.49
RAPGEF4 Q8WZA2 1/20 0.49
TDP1 Q9NUW8 2/20 0.48
RAB9A P51151 2/20 0.48
ATM Q13315 2/20 0.48
CTRB1 P17538 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
SCHEMBL29520895 1.00 CYP1A2 (0.54) CYP1A2GLO1L3MBTL1NPC1MAPT
SCHEMBL11955356 1.00 CYP1A2 (0.54) CYP1A2GLO1L3MBTL1NPC1MAPT
SCHEMBL27157136 0.92 IDO1 (0.59) CYP1A2GLO1L3MBTL1NPC1MAPT
SCHEMBL7201502 0.88 IDO1 (0.65) CYP1A2GLO1L3MBTL1NPC1MAPT
SCHEMBL11697430 0.86 MAPT (0.69) CYP1A2GLO1L3MBTL1NPC1MAPT
SCHEMBL30854927 0.85 CYP1A2 (0.56) CYP1A2L3MBTL1NPC1MAPTKDM4E
SCHEMBL7543544 0.84 MAPT (0.67) CYP1A2L3MBTL1NPC1MAPTKDM4E
SCHEMBL7189843 0.84 MAPT (0.67) CYP1A2L3MBTL1NPC1MAPTKDM4E
SCHEMBL7650795 0.83 CYP1A2 (0.58) CYP1A2L3MBTL1NPC1MAPTKDM4E
SCHEMBL2291745 0.83 CYP1A2 (0.58) CYP1A2L3MBTL1NPC1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109467836-B Super-high-elasticity medical PVC pump pipe material and preparation method and application thereof 浙江天原医用材料有限公司 2021-02-26 CN claimed
CN-106700311-B Light-resistant medical PVC infusion tube composition and preparation method thereof 中国石油化工股份有限公司 2020-04-14 CN claimed
CN-109467836-A A kind of medical PVC pump line material of super-elastic and preparation method thereof, application 浙江天原医用材料有限公司 2019-03-15 CN claimed
CN-106700311-A Light-shielding type medical PVC (Polyvinyl Chloride) infusion tube composition and preparation method of light-shielding type medical PVC infusion tube composition 中国石油化工股份有限公司 2017-05-24 CN claimed
CN-111057329-B Light-avoiding PVC composition for disposable blood transfusion and fluid infusion catheter and preparation method thereof 中国石油化工股份有限公司 2022-04-08 CN disclosed
CN-109467836-B Super-high-elasticity medical PVC pump pipe material and preparation method and application thereof 浙江天原医用材料有限公司 2021-02-26 CN disclosed
CN-109486052-B Medical PVC broadband light-resistant aggregate and preparation method and application thereof 浙江天原医用材料有限公司 2020-10-02 CN disclosed
CN-111057329-A Light-avoiding PVC composition for disposable blood transfusion and fluid infusion catheter and preparation method thereof 中国石油化工股份有限公司 2020-04-24 CN disclosed
CN-106700311-B Light-resistant medical PVC infusion tube composition and preparation method thereof 中国石油化工股份有限公司 2020-04-14 CN disclosed
CN-106700311-B Light-resistant medical PVC infusion tube composition and preparation method thereof 中国石油化工股份有限公司 2020-04-14 CN disclosed
CN-109486052-A A kind of new medical PVC broadband is protected from light pellet and preparation method thereof, application 浙江天原医用材料有限公司 2019-03-19 CN disclosed
CN-109467836-A A kind of medical PVC pump line material of super-elastic and preparation method thereof, application 浙江天原医用材料有限公司 2019-03-15 CN disclosed
CN-106700311-A Light-shielding type medical PVC (Polyvinyl Chloride) infusion tube composition and preparation method of light-shielding type medical PVC infusion tube composition 中国石油化工股份有限公司 2017-05-24 CN disclosed
CN-106700311-A Light-shielding type medical PVC (Polyvinyl Chloride) infusion tube composition and preparation method of light-shielding type medical PVC infusion tube composition 中国石油化工股份有限公司 2017-05-24 CN disclosed
CN-1441637-A Compositions for repelling crawling insects BAYER AG (DE) 2003-09-10 CN disclosed
US-20020094993-A1 Compositions for repelling crawling insects S.C. JOHNSON & SON, INC. 2002-07-18 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-20020094993-A1 Compositions for repelling crawling insects ACHE, DDT, GAP43 CYP1A2 1275/4885GLO1 274/4885L3MBTL1 80/4885

“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.