SCHEMBL2890887

SCHEMBL2890887

O=C1C=C(N(Cc2ccc(C(F)(F)F)nc2)C2CC2)CO1

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
DAO P14920 3/20 0.36
KDM1A O60341 2/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
KCNH2 Q12809 2/20 0.34
EGLN2 Q96KS0 2/20 0.34
EGLN1 Q9GZT9 2/20 0.34
EGLN3 Q9H6Z9 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP3A5 P20815 1/20 0.34
GPR119 Q8TDV5 1/20 0.34
CTSL P07711 1/20 0.32
TRPV1 Q8NER1 1/20 0.32
TRPV4 Q9HBA0 1/20 0.32
PPARD Q03181 1/20 0.32
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 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
SCHEMBL1164998 0.86 KDM1A (0.35) DAOKDM1AMAOAMAOBKCNH2
SCHEMBL2892825 0.83 KCNH2 (0.42) DAOKDM1AMAOAMAOBOPRM1
SCHEMBL14134644 0.83 PDE10A (0.33)
SCHEMBL19846470 0.79 DAO (0.35) DAOKDM1AMAOAMAOBOPRM1
SCHEMBL487542 0.79
SCHEMBL28810661 0.77 KDM4E (0.42) OPRM1OPRL1CTSL
SCHEMBL2896122 0.75 CTSL (0.30) CTSL
SCHEMBL119799 0.75 CTSL (0.30) CTSL
SCHEMBL14995923 0.75 CTSL (0.32) CTSLPDE3BPDE3A
SCHEMBL2894228 0.75 ALDH1A1 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100285965-A1 METHODS OF IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2010-11-11 US claimed
EP-2194785-A2 METHODS OF IMPROVING PLANT GROWTH Bayer CropScience AG (DE) 2010-06-16 EP claimed
EP-2090168-A1 Method for improving plant growth Bayer CropScience AG (DE) 2009-08-19 EP claimed
WO-2009046837-A2 METHODS OF IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2009-04-16 WO claimed
EP-2044841-A1 Method for improving plant growth Bayer CropScience AG (DE) 2009-04-08 EP claimed
US-20130303376-A1 METHODS OF IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2013-11-14 US disclosed
US-20100285965-A1 METHODS OF IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2010-11-11 US disclosed
US-20100285965-A1 METHODS OF IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2010-11-11 US disclosed
US-20100285965-A1 METHODS OF IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2010-11-11 US disclosed
US-20100173943-A1 INSECTICIDAL COMPOSITIONS WITH IMPROVED ACTION BAYER CROPSCIENCE AG (DE) 2010-07-08 US disclosed
US-20100173943-A1 INSECTICIDAL COMPOSITIONS WITH IMPROVED ACTION BAYER CROPSCIENCE AG (DE) 2010-07-08 US disclosed
US-20100173943-A1 INSECTICIDAL COMPOSITIONS WITH IMPROVED ACTION BAYER CROPSCIENCE AG (DE) 2010-07-08 US disclosed
EP-2090168-A1 Method for improving plant growth Bayer CropScience AG (DE) 2009-08-19 EP disclosed
EP-2090168-A1 Method for improving plant growth Bayer CropScience AG (DE) 2009-08-19 EP disclosed
WO-2009046837-A2 METHODS OF IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2009-04-16 WO disclosed
EP-2044841-A1 Method for improving plant growth Bayer CropScience AG (DE) 2009-04-08 EP disclosed
EP-2044841-A1 Method for improving plant growth Bayer CropScience AG (DE) 2009-04-08 EP disclosed
WO-2008148483-A1 INSECTICIDE COMPOSITIONS HAVING AN IMPROVED EFFECT BAYER CROPSCIENCE AG (DE) 2008-12-11 WO disclosed
WO-2008148483-A1 INSECTICIDE COMPOSITIONS HAVING AN IMPROVED EFFECT BAYER CROPSCIENCE AG (DE) 2008-12-11 WO disclosed
EP-2000027-A1 Insecticide compounds with improved effect Bayer CropScience AG (DE) 2008-12-10 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-20100285965-A1 METHODS OF IMPROVING PLANT GROWTH MYCBP, MYB, MRPL37 DAO 231/4885KDM1A 2674/4885MAOA 3547/4885
US-20100173943-A1 INSECTICIDAL COMPOSITIONS WITH IMPROVED ACTION PTEN, PHOSPHO1, ACHE DAO 1105/4885KDM1A 2731/4885MAOA 4080/4885
US-20130303376-A1 METHODS OF IMPROVING PLANT GROWTH MYCBP, MYB, MRPL37 DAO 211/4885KDM1A 2468/4885MAOA 3564/4885

“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.