SCHEMBL696077

SCHEMBL696077

CO/N=C(\C)c1c[c]ccc1

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.39
LMNA P02545 2/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.34
PKM P14618 1/20 0.34
CDK5 Q00535 1/20 0.34
CDK5R1 Q15078 1/20 0.34
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
HIF1A Q16665 1/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
PTBP1 P26599 1/20 0.30

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
SCHEMBL696078 1.00 L3MBTL1 (0.39) L3MBTL1LMNAMAPK1HTTMAPT
SCHEMBL6970352 1.00 L3MBTL1 (0.39) L3MBTL1LMNAMAPK1HTTMAPT
SCHEMBL695964 0.81 LMNA (0.47) L3MBTL1LMNAMAPK1HTTMAPT
SCHEMBL695965 0.81 LMNA (0.47) L3MBTL1LMNAMAPK1HTTMAPT
SCHEMBL695779 0.81 L3MBTL1 (0.36) L3MBTL1LMNAMAPK1HTTNPC1
SCHEMBL695780 0.81 L3MBTL1 (0.36) L3MBTL1LMNAMAPK1HTTNPC1
SCHEMBL6345644 0.81 L3MBTL1 (0.36) L3MBTL1LMNAMAPK1HTTNPC1
SCHEMBL6345600 0.81 LMNA (0.47) L3MBTL1LMNAMAPK1HTTMAPT
SCHEMBL6972037 0.80 NPC1 (0.36) LMNAHTTMAPTPKMCDK5
SCHEMBL6972040 0.80 NPC1 (0.36) LMNAHTTMAPTPKMCDK5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9770027-B2 Heteroarylpiperidine and -piperazine derivatives as fungicides BAYER CROPSCIENCE AG (DE) 2017-09-26 US disclosed
US-20150351403-A1 Heteroarylpiperidine and -piperazine derivatives as fungicides BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2015-12-10 US disclosed
US-9150565-B2 Heteroarylpiperidine and -piperazine derivatives as fungicides BAYER CROPSCIENCE AG (DE) 2015-10-06 US disclosed
US-20140206646-A1 Heteroarylpiperidine and -piperazine derivatives as fungicides BAYER CROPSCIENCE AG (DE) 2014-07-24 US disclosed
US-8759527-B2 Heteroarylpiperidine and -piperazine derivatives as fungicides BAYER CROPSCIENCE AG (DE) 2014-06-24 US disclosed
EP-2423210-A1 Heteroarylpiperidine and heteroarylpiperazine derivatives as fungicides Bayer CropScience AG (DE) 2012-02-29 EP disclosed
US-20050101783-A1 N-(heterocycle-methyl)alkylamine derivative, process for producing the same, and bactericide KUREHA CORPORATION (JP) 2005-05-12 US disclosed
EP-1329160-A2 4-ACYLAMINOPYRAZOLE DERIVATIVES Sankyo Company, Limited (JP) 2003-07-23 EP 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 (3 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-20050101783-A1 N-(heterocycle-methyl)alkylamine derivative, process for producing the same, and bactericide HBZ, ACMSD, HDHD5 L3MBTL1 1563/4885LMNA 2729/4885MAPK1 1370/4885
US-20150351403-A1 Heteroarylpiperidine and -piperazine derivatives as fungicides CYP1A1, PRXL2A, CYP1A2 L3MBTL1 1885/4885LMNA 2746/4885MAPK1 1463/4885
US-20140206646-A1 Heteroarylpiperidine and -piperazine derivatives as fungicides CYP1A1, PRXL2A, CYP1A2 L3MBTL1 1885/4885LMNA 2746/4885MAPK1 1463/4885

“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.