SCHEMBL4108607

SCHEMBL4108607

CCCCCN=c1cccc[nH]1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR5A P47898 2/20 0.39
KCNA3 P22001 6/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2D6 P10635 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
MEN1 O00255 1/20 0.35
TP53 P04637 1/20 0.35
CYP3A4 P08684 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
KMT2A Q03164 1/20 0.35
GSK3B P49841 2/20 0.35
KDM4E B2RXH2 1/20 0.33
LMNA P02545 1/20 0.33
SCN2A Q99250 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
MMP2 P08253 2/20 0.32
MMP9 P14780 2/20 0.32

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
SCHEMBL15842012 1.00 HTR5A (0.39) HTR5AKCNA3CYP1A2CYP2D6CYP2C9
SCHEMBL22627535 0.78
SCHEMBL6244955 0.74 TAAR1 (0.35) MEN1KMT2A
SCHEMBL10509524 0.70 TDP1 (0.34) CYP1A2CYP2D6CYP2C9CYP2C19CYP3A4
SCHEMBL10583695 0.70 TDP1 (0.34) CYP1A2CYP2D6CYP2C9CYP2C19CYP3A4
SCHEMBL10585757 0.70 TDP1 (0.34) CYP1A2CYP2D6CYP2C9CYP2C19CYP3A4
SCHEMBL4562954 0.68 C3AR1 (0.53) HTR5AKCNA3CYP1A2CYP2D6CYP2C9
SCHEMBL4562956 0.68 C3AR1 (0.53) HTR5AKCNA3CYP1A2CYP2D6CYP2C9
SCHEMBL3212571 0.67 MMP1 (0.40) CYP1A2CYP2C19MEN1KMT2AGAA
Octane SCHEMBL28084975 0.67 FKBP5 (0.67) MMP2MMP9MMP3GPR84MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114716369-A Optimum method for producing pest control agent 株式会社MMAG 2022-07-08 CN disclosed
CN-109715606-B Optimum method for producing pest control agent 株式会社MMAG 2022-05-10 CN disclosed
EP-3318554-B1 METHOD FOR PRODUCING PEST CONTROL AGENT MEIJI SEIKA PHARMA CO LTD (JP) 2021-11-03 EP disclosed
EP-3118194-B1 METHOD FOR PRODUCING 2-ACYLIMINOPYRIDINE DERIVATIVE MEIJI SEIKA PHARMA CO LTD (JP) 2020-07-29 EP disclosed
US-20190270709-A1 OPTIMIZED PRODUCTION METHOD FOR PEST CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2019-09-05 US disclosed
EP-3514144-A1 OPTIMIZED PRODUCTION METHOD FOR PEST CONTROL AGENT Meiji Seika Pharma Co., Ltd. (JP) 2019-07-24 EP disclosed
EP-2749555-B1 METHOD FOR PRODUCING PEST CONTROLLING AGENT MEIJI SEIKA PHARMA CO LTD (JP) 2018-11-14 EP disclosed
US-9975851-B2 Method for producing 2-acyliminopyridine derivative MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-05-22 US disclosed
US-9975851-B2 Method for producing 2-acyliminopyridine derivative MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-05-22 US disclosed
EP-3318554-A1 METHOD FOR PRODUCING PEST CONTROL AGENT Meiji Seika Pharma Co., Ltd. (JP) 2018-05-09 EP disclosed
US-20140213791-A1 METHOD FOR PRODUCING PEST CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-07-31 US disclosed
US-20140213791-A1 METHOD FOR PRODUCING PEST CONTROL AGENT MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-07-31 US disclosed
EP-2749559-A1 5-substituted isoindoline compounds CELGENE CORPORATION (US) 2014-07-02 EP disclosed
EP-2749555-A1 METHOD FOR PRODUCING PEST CONTROLLING AGENT Meiji Seika Pharma Co., Ltd. (JP) 2014-07-02 EP disclosed
EP-2749555-A1 METHOD FOR PRODUCING PEST CONTROLLING AGENT Meiji Seika Pharma Co., Ltd. (JP) 2014-07-02 EP disclosed
CN-100519491-C Process for making a linear alpha-olefin oligomer using a heat exchanger Shell int research co ltd (NL) 2009-07-29 CN disclosed
EP-1546069-B1 PROCESS FOR MAKING A LINEAR ALPHA-OLEFIN OLIGOMER USING A HEAT EXCHANGER SHELL INT RESEARCH (NL) 2009-05-27 EP disclosed
CN-1735576-A Process for making a linear alpha-olefin oligomer using a heat exchanger SHELL INTRNAT RES B V (NL) 2006-02-15 CN disclosed
EP-1546069-A1 PROCESS FOR MAKING A LINEAR ALPHA-OLEFIN OLIGOMER USING A HEAT EXCHANGER SHELL INTERNATIONALE RESEARCHMAATSCHAPPIJ B.V. (NL) 2005-06-29 EP disclosed
WO-2004029012-A1 PROCESS FOR MAKING A LINEAR ALPHA-OLEFIN OLIGOMER USING A HEAT EXCHANGER SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) 2004-04-08 WO 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 (2 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-20140213791-A1 METHOD FOR PRODUCING PEST CONTROL AGENT AADAC, ACOT7, APEH HTR5A 2048/4885KCNA3 1188/4885CYP1A2 106/4885
US-20190270709-A1 OPTIMIZED PRODUCTION METHOD FOR PEST CONTROL AGENT NAAA, AKR7A2, DDT HTR5A 4736/4885KCNA3 2533/4885CYP1A2 169/4885

“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.