SCHEMBL3653609

SCHEMBL3653609

N#Cc1c(Cl)nc(C(F)(F)F)nc1C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
HTT P42858 5/20 0.35
LMNA P02545 2/20 0.35
MAPT P10636 2/20 0.35
POLB P06746 1/20 0.35
NCOA1 Q15788 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HIF1A Q16665 1/20 0.35
NCOA3 Q9Y6Q9 1/20 0.35
XBP1 P17861 1/20 0.35
KDM4E B2RXH2 2/20 0.33
MAPK1 P28482 2/20 0.33
NSD2 O96028 1/20 0.33
ABCC8 Q09428 1/20 0.33
KCNJ11 Q14654 1/20 0.33
SLC34A1 Q06495 2/20 0.32
KMT2A Q03164 2/20 0.31
MEN1 O00255 1/20 0.31
NPY1R P25929 1/20 0.31
NPY2R P49146 1/20 0.31

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
SCHEMBL15955510 0.75 KMT2A (0.46) ALDH1A1HTTLMNAMAPTHIF1A
SCHEMBL31283265 0.68 HTT (0.40) ALDH1A1HTTLMNAMAPTPOLB
SCHEMBL15110967 0.68 HTT (0.40) ALDH1A1HTTLMNAMAPTPOLB
SCHEMBL2116132 0.67
SCHEMBL15110941 0.66 HTT (0.44) ALDH1A1HTTLMNAMAPTPOLB
SCHEMBL15110846 0.66 HTT (0.38) ALDH1A1HTTLMNAMAPTPOLB
SCHEMBL24589991 0.65 NT5E (0.38) ALDH1A1HTTLMNAMAPTPOLB
SCHEMBL29493825 0.65 L3MBTL1 (0.36) ALDH1A1HTTLMNAMAPTKDM4E
SCHEMBL29697387 0.65 NT5E (0.38) ALDH1A1HTTLMNAMAPTPOLB
SCHEMBL27170662 0.65 L3MBTL1 (0.36) ALDH1A1HTTLMNAMAPTKDM4E

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
WO-2014149206-A1 PYRAZOLOPYRIMIDINE-BASED INSECTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC (US) 2014-09-25 WO disclosed
WO-2014149206-A1 PYRAZOLOPYRIMIDINE-BASED INSECTICIDAL COMPOSITIONS AND RELATED METHODS DOW AGROSCIENCES LLC (US) 2014-09-25 WO disclosed
WO-2014126580-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-08-21 WO disclosed
WO-2014126580-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2014-08-21 WO disclosed
WO-2013106254-A1 PESTICIDAL COMPOSITIONS AND PROCESSES RELATED THERETO DOW AGROSCIENCES LLC (US) 2013-07-18 WO disclosed
US-8445500-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2013-05-21 US disclosed
US-8445500-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2013-05-21 US disclosed
US-8445500-B2 Pesticidal compositions DOW AGROSCIENCES, LLC. (US) 2013-05-21 US disclosed
US-20120329821-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2012-12-27 US disclosed
US-20120329821-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2012-12-27 US disclosed
US-20120329821-A1 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2012-12-27 US disclosed
US-8288392-B2 Diheteroarylhydrazine parasiticides for topical or oral treatment of animals Dow AgroSciences, L.L.C. (US) 2012-10-16 US disclosed
EP-2194788-A2 PESTICIDAL COMPOSITIONS Dow AgroSciences LLC (US) 2010-06-16 EP disclosed
WO-2009045702-A2 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2009-04-09 WO disclosed
WO-2009045702-A2 PESTICIDAL COMPOSITIONS DOW AGROSCIENCES LLC (US) 2009-04-09 WO disclosed
US-20090093500-A1 Diheteroarylhydrazine parasiticides for topical or oral treatment of animals DOW AGROSCIENCES LLC (US) 2009-04-09 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 (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-20120329821-A1 PESTICIDAL COMPOSITIONS ACHE, DDT, PTMS ALDH1A1 2421/4885HTT 2653/4885LMNA 3728/4885
US-20090093500-A1 Diheteroarylhydrazine parasiticides for topical or oral treatment of animals DDT, CYP4Z1, DOHH ALDH1A1 1650/4885HTT 1091/4885LMNA 4542/4885

“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.