SCHEMBL10195272

SCHEMBL10195272

CCc1ccc(Oc2cc(C(F)(F)F)ccn2)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
CASP3 P42574 1/20 0.38
RAB9A P51151 1/20 0.38
SENP8 Q96LD8 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
SENP6 Q9GZR1 1/20 0.38
BACE1 P56817 1/20 0.37
MGLL Q99685 2/20 0.36
SCN9A Q15858 2/20 0.35
SCN7A Q01118 1/20 0.35
KCNH2 Q12809 1/20 0.35
FPR2 P25090 1/20 0.34
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
P2RX3 P56373 4/20 0.33
FAAH O00519 1/20 0.33
DGAT2 Q96PD7 1/20 0.32
BRAF P15056 2/20 0.31
KDR P35968 2/20 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
SCHEMBL10195117 0.87 MAPK1 (0.45) RAB9ASCN9AMAPK1
SCHEMBL10195167 0.87 DRD1 (0.36)
SCHEMBL10195296 0.86 PPARG (0.35) P2RX3
SCHEMBL10195265 0.85 PTDSS1 (0.35) RAB9AKCNH2ALDH1A1KDR
SCHEMBL10195200 0.85 MMP14 (0.35) NPC1RAB9AFFAR1
SCHEMBL10195314 0.85 KIF11 (0.39) SCN9AALDH1A1L3MBTL1FAAHMAPK14
SCHEMBL10195160 0.84 PTGS2 (0.40) BACE1MGLLSCN7AKCNH2L3MBTL1
SCHEMBL10195277 0.83 BACE1 (0.36) BACE1P2RX3
SCHEMBL10195285 0.83 KMT2A (0.38) NPC1RAB9ABACE1ALDH1A1GAA
SCHEMBL10195212 0.83 BTK (0.31) MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387569-B1 HERBCIDES SYNGENTA LTD (GB) 2016-06-15 EP disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-20140378305-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2014-12-25 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-8865623-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and method of controlling weeds SYNGENTA LIMITED (GB) 2014-10-21 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
US-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
WO-2010081755-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-07-22 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-20140378305-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 NPC1 4365/4885CASP3 584/4885RAB9A 2665/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 NPC1 4585/4885CASP3 940/4885RAB9A 3044/4885

“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.