SCHEMBL1900167

SCHEMBL1900167

Cn1cc(C(=O)Nc2cc(Cl)c(F)cc2-c2cccc(Cl)c2)c(C(F)F)n1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 5/20 0.44
JAK1 P23458 1/20 0.44
MAPT P10636 1/20 0.41
DCAF1 Q9Y4B6 1/20 0.40
MAPK1 P28482 4/20 0.40
NTRK1 P04629 1/20 0.40
CHRM3 P20309 3/20 0.39
CSNK1D P48730 2/20 0.39
CSNK1E P49674 2/20 0.39
FABP4 P15090 1/20 0.38
TP53 P04637 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL28496948 0.94 JAK2 (0.45) JAK2JAK1MAPTDCAF1MAPK1
SCHEMBL1134824 0.87 CHRM3 (0.51) JAK2JAK1DCAF1CHRM3
SCHEMBL302468 0.87 JAK2 (0.48) JAK2JAK1MAPTDCAF1CHRM3
SCHEMBL29451182 0.84 TP53 (0.40) JAK2JAK1MAPTMAPK1NTRK1
SCHEMBL16594331 0.84 TP53 (0.40) JAK2JAK1MAPTMAPK1NTRK1
SCHEMBL28939590 0.83 JAK2 (0.44) JAK2JAK1MAPTDCAF1MAPK1
SCHEMBL1144969 0.82 CHRM3 (0.43) MAPK1CHRM3CSNK1DCSNK1ETP53
SCHEMBL1136276 0.82 CHRM3 (0.51) CHRM3
SCHEMBL1767591 0.81 CHRM3 (0.46) JAK2JAK1MAPTNTRK1CHRM3
SCHEMBL303047 0.80 CHRM3 (0.51) MAPK1CHRM3CSNK1DCSNK1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2233000-B1 Post-harvest treatment BAYER IP GMBH (DE) 2016-07-13 EP claimed
EP-2258178-B1 Use of alkykl carboxylic acid amides as penetration promoters BAYER CROPSCIENCE AG (DE) 2012-07-04 EP claimed
US-9743674-B2 Combinations comprising a fungicidal strain and an active compound BAYER CROPSCIENCE LP (US) 2017-08-29 US disclosed
US-20160295869-A1 Combinations Comprising a Fungicidal Strain and an Active Compound BAYER CROPSCIENCE LP 2016-10-13 US disclosed
US-20130303376-A1 METHODS OF IMPROVING PLANT GROWTH BAYER CROPSCIENCE AG (DE) 2013-11-14 US disclosed
EP-1796468-B1 Synergistic fungicidal active substance combinations containing spiroxamine, prothioconazole and bixafen BAYER CROPSCIENCE AG (DE) 2011-05-25 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 (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-20160295869-A1 Combinations Comprising a Fungicidal Strain and an Active Compound O60361, SPOUT1, FBL JAK2 3988/4885JAK1 2790/4885MAPT 3739/4885
US-20130303376-A1 METHODS OF IMPROVING PLANT GROWTH MYCBP, MYB, MRPL37 JAK2 3148/4885JAK1 3112/4885MAPT 3479/4885

“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.