SCHEMBL2940314

SCHEMBL2940314

Nc1ccccc1OC(F)(F)C(F)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.41
ADRA2B P18089 1/20 0.41
PTGS1 P23219 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 2/20 0.40
TSHR P16473 2/20 0.40
HSD17B10 Q99714 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CRHBP P24387 1/20 0.40
CRHR2 Q13324 1/20 0.40
RECQL P46063 2/20 0.38
CYP1A2 P05177 2/20 0.37
CYP2C19 P33261 2/20 0.37
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 1/20 0.34
ALOX15 P16050 2/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
KMT2A Q03164 1/20 0.34
GAA P10253 2/20 0.33

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
SCHEMBL418646 0.86 ALDH1A1 (0.45) ALDH1A1ADRA2BPTGS1TDP1MAPT
SCHEMBL7751671 0.86 ALDH1A1 (0.46) ALDH1A1MAPTTSHRHSD17B10KDM4E
SCHEMBL3075356 0.81 ALDH1A1 (0.41) ALDH1A1ADRA2BPTGS1TDP1MAPT
SCHEMBL7751907 0.79 ALDH1A1 (0.41) ALDH1A1PTGS1MAPTTSHRHSD17B10
SCHEMBL10771075 0.76 L3MBTL1 (0.48) ALDH1A1MAPTTSHRHSD17B10KDM4E
SCHEMBL10683029 0.76 LTA4H (0.41) ALDH1A1MAPTTSHRHSD17B10KDM4E
SCHEMBL112134 0.76 ALDH1A1 (0.50) ALDH1A1ADRA2BPTGS1TDP1MAPT
SCHEMBL29893374 0.76 ALDH1A1 (0.50) ALDH1A1ADRA2BPTGS1TDP1MAPT
SCHEMBL6555055 0.75 RECQL (0.40) ALDH1A1MAPTTSHRHSD17B10RECQL
SCHEMBL8528296 0.75 RECQL (0.40) ALDH1A1ADRA2BPTGS1MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2229057-A1 FUNGICIDAL COMPOSITIONS Syngenta Participations AG (CH) 2010-09-22 EP claimed
EP-2150113-A1 FUNGICIDAL COMPOSITIONS Syngeta Participations AG (CH) 2010-02-10 EP claimed
WO-2009090038-A1 FUNGICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2009-07-23 WO claimed
US-20090011935-A1 Method of Inducing Tolerance of Plants Against Bacterioses BASF SE (DE) 2009-01-08 US claimed
EP-1996018-A2 METHOD OF INDUCING TOLERANCE OF PLANTS AGAINST BACTERIOSES BASF SE (DE) 2008-12-03 EP claimed
WO-2008131901-A1 FUNGICIDAL COMPOSITIONS SYNGENTA PARTICIPATIONS AG (CH) 2008-11-06 WO claimed
WO-2007104658-A2 METHOD OF INDUCING TOLERANCE OF PLANTS AGAINST BACTERIOSES BASF SE (DE) 2007-09-20 WO claimed
EP-2640707-B1 5-HALOGENOPYRAZOLECARBOXAMIDES BAYER IP GMBH (DE) 2017-03-15 EP disclosed
US-9375004-B2 5-halogenopyrazolecarboxamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-06-28 US disclosed
US-20130296269-A1 5-Halogenopyrazolecarboxamides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2013-11-07 US disclosed
US-20100222217-A1 Fungicidal N-[2-(Haloalkoxy)Phenyl]Heteroarylcarboxamides BASF AKTIENGESELLSCHAFT (DE) 2010-09-02 US disclosed
WO-2009124920-A2 EMULSIFIABLE CONCENTRATE BASF SE (DE) 2009-10-15 WO disclosed
US-20090011935-A1 Method of Inducing Tolerance of Plants Against Bacterioses BASF SE (DE) 2009-01-08 US disclosed
EP-1996018-A2 METHOD OF INDUCING TOLERANCE OF PLANTS AGAINST BACTERIOSES BASF SE (DE) 2008-12-03 EP disclosed
EP-1912497-A1 FUNGICIDAL N-[2-(HALOALKOXY)PHENYL]HETEROARYLCARBOXAMIDES BASF SE (DE) 2008-04-23 EP disclosed
WO-2007104658-A2 METHOD OF INDUCING TOLERANCE OF PLANTS AGAINST BACTERIOSES BASF SE (DE) 2007-09-20 WO disclosed
WO-2007017450-A1 FUNGICIDAL N-[2-(HALOALKOXY)PHENYL]HETEROARYLCARBOXAMIDES BASF SE (DE) 2007-02-15 WO disclosed
EP-0318782-A2 Substituted benzoyl(thio) ureas BAYER AG (DE) 1989-06-07 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-20090011935-A1 Method of Inducing Tolerance of Plants Against Bacterioses BROX, CAT, SLC11A2 ALDH1A1 2207/4885ADRA2B 4468/4885PTGS1 262/4885
US-20130296269-A1 5-Halogenopyrazolecarboxamides CYP3A5, CBR3, HDHD5 ALDH1A1 3455/4885ADRA2B 4484/4885PTGS1 4510/4885
US-20100222217-A1 Fungicidal N-[2-(Haloalkoxy)Phenyl]Heteroarylcarboxamides CBR3, HDHD5, CYP8B1 ALDH1A1 1188/4885ADRA2B 2818/4885PTGS1 2278/4885

“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.