SCHEMBL10195487

SCHEMBL10195487

CCc1ccc(Oc2ccc(C(F)(F)F)c(Cl)c2)cc1C1=C(O)CC(C)(C)CC1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.38
MAPK1 P28482 2/20 0.38
SMN1; SMN2 Q16637 4/20 0.37
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
HTT P42858 1/20 0.32
MAPT P10636 4/20 0.32
NPC1 O15118 1/20 0.32
HPGD P15428 1/20 0.32
MEN1 O00255 1/20 0.31
PSMD14 O00487 1/20 0.31
KMT2A Q03164 1/20 0.31
BRAF P15056 1/20 0.31
HDAC1 Q13547 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
SCHEMBL16351660 0.93 SMN1; SMN2 (0.36) ALDH1A1MAPK1SMN1; SMN2LMNATSHR
SCHEMBL10195451 0.87 SMN1; SMN2 (0.39) ALDH1A1MAPK1SMN1; SMN2LMNATSHR
SCHEMBL10196195 0.86 MRGPRX4 (0.35) ALDH1A1SMN1; SMN2LMNAMRGPRX4THRA
SCHEMBL16181148 0.86 SMN1; SMN2 (0.39) ALDH1A1MAPK1SMN1; SMN2LMNATSHR
SCHEMBL10195503 0.86 AR (0.41)
SCHEMBL10195479 0.85 PLA2G7 (0.32) ALDH1A1MRGPRX4THRATHRB
SCHEMBL10195449 0.85 SMN1; SMN2 (0.39) ALDH1A1MAPK1SMN1; SMN2LMNATSHR
SCHEMBL10194979 0.85 SMN1; SMN2 (0.39) ALDH1A1MAPK1SMN1; SMN2LMNATSHR
SCHEMBL10195106 0.84 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2LMNATSHRCASP1
SCHEMBL10195482 0.84 ALDH1A1 (0.45) ALDH1A1MAPK1SMN1; SMN2MRGPRX4MAPT

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 ALDH1A1 45/4885MAPK1 2927/4885SMN1; SMN2 2218/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ALDH1A1 14/4885MAPK1 2263/4885SMN1; SMN2 2952/4885

“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.