SCHEMBL1201249

SCHEMBL1201249

CC(C)CCCOc1ccc(N)c(-c2ccccc2)n1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.40
LTB4R Q15722 6/20 0.38
MCHR1 Q99705 1/20 0.37
BCHE P06276 1/20 0.37
ACHE P22303 1/20 0.37
PPIA P62937 1/20 0.37
SOAT1 P35610 1/20 0.36
HRH4 Q9H3N8 1/20 0.35
RPS6KA5 O75582 1/20 0.35
AKT1 P31749 1/20 0.35
RPS6KA1 Q15418 1/20 0.35
HTT P42858 1/20 0.34
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL16976164 0.84 PDE10A (0.40) TLR8LTB4RPPIASOAT1
SCHEMBL1200414 0.78 MEN1 (0.41) LTB4RPPIANPC1MAPK1RAB9A
SCHEMBL1201915 0.77 TLR8 (0.40) TLR8LTB4RSOAT1HRH4MAPK1
SCHEMBL1201803 0.76 TLR8 (0.37) TLR8LTB4RMCHR1BCHEACHE
SCHEMBL1201893 0.75 TLR8 (0.37) TLR8MCHR1BCHEACHEPPIA
SCHEMBL12878992 0.73 SOAT1 (0.32) LTB4RPPIASOAT1
SCHEMBL15195552 0.72 TLR8 (0.41) TLR8MCHR1PPIAHTTNPC1
SCHEMBL11844469 0.71 CYP1A2 (0.65) TLR8MCHR1PPIAHTTALDH1A1
SCHEMBL27793945 0.70 PPIA (0.41) TLR8BCHEACHEPPIAALDH1A1
SCHEMBL1200373 0.70 TLR8 (0.37) TLR8MCHR1BCHEACHEPPIA

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
US-9096525-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION, LLC (US) 2015-08-04 US disclosed
US-9096525-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION, LLC (US) 2015-08-04 US disclosed
US-9096525-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION, LLC (US) 2015-08-04 US disclosed
US-20130338105-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES SYNGENTA CROP PROTECTION LLC (US) 2013-12-19 US disclosed
CN-103396359-A Iminipyridine derivatives and uses thereof as microbiocides SYNGENTA PARTICIPATIONS A G 2013-11-20 CN disclosed
CN-101657423-B Iminopyridine derivatives and their use as microbicides SYNGENTA PARTICIPATIONS AG 2013-11-06 CN disclosed
US-8513286-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION LLC (US) 2013-08-20 US disclosed
US-8513286-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION LLC (US) 2013-08-20 US disclosed
US-8513286-B2 Iminipyridine derivatives and their uses as microbiocides SYNGENTA CROP PROTECTION LLC (US) 2013-08-20 US disclosed
US-20110046088-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-02-24 US disclosed
US-20110046088-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-02-24 US disclosed
US-20110046088-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES SYNGENTA CROP PROTECTION, INC. (US) 2011-02-24 US disclosed
CN-101657423-A Iminopyridine derivatives and their use as microbicides SYNGENTA LTD 2010-02-24 CN disclosed
EP-2125734-A2 NOVEL MICROBIOCIDES Syngeta Participations AG (CH) 2009-12-02 EP disclosed
WO-2008101682-A2 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-08-28 WO disclosed
WO-2008101682-A2 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-08-28 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-20110046088-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES CD14, MYADM, MPO TLR8 106/4885LTB4R 498/4885MCHR1 1601/4885
US-20130338105-A1 IMINIPYRIDINE DERIVATIVES AND THEIR USES AS MICROBIOCIDES CD14, MYADM, MPO TLR8 108/4885LTB4R 642/4885MCHR1 1575/4885

“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.