SCHEMBL10195393

SCHEMBL10195393

CCc1ccc(Oc2ccc(F)cc2[N+](=O)[O-])cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSPB1 P04792 4/20 0.43
CRHBP P24387 1/20 0.38
CRHR2 Q13324 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.36
ALDH1A1 P00352 6/20 0.36
MAPT P10636 4/20 0.36
KDM4E B2RXH2 4/20 0.36
GAA P10253 4/20 0.36
LMNA P02545 3/20 0.36
HTT P42858 3/20 0.36
GLA P06280 2/20 0.36
HPGD P15428 1/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 2/20 0.36
THRB P10828 1/20 0.36
MAPK1 P28482 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 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
SCHEMBL10195340 0.91 ALDH1A1 (0.45) HSPB1L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL16351664 0.90 ALDH1A1 (0.41) HSPB1L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL10195376 0.89 PDE7A (0.44) HSPB1ALDH1A1MAPTKDM4EGAA
SCHEMBL10195377 0.89 LMNA (0.38) HSPB1L3MBTL1ALDH1A1MAPTKDM4E
SCHEMBL10195333 0.89 HSPB1 (0.34) HSPB1CRHBPCRHR2L3MBTL1ALDH1A1
SCHEMBL10195344 0.89 MAPT (0.43) L3MBTL1ALDH1A1MAPTKDM4EGAA
SCHEMBL16361691 0.88 LMNA (0.35) HSPB1CRHBPCRHR2L3MBTL1ALDH1A1
SCHEMBL16351689 0.88 ALDH1A1 (0.38) HSPB1ALDH1A1MAPTKDM4EGAA
SCHEMBL10195084 0.87 MAPK14 (0.42) HSPB1
SCHEMBL10195046 0.86 HSPB1 (0.42) HSPB1L3MBTL1ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20120021907-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US 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 HSPB1 1790/4885CRHBP 4370/4885CRHR2 3544/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 HSPB1 1045/4885CRHBP 3551/4885CRHR2 2583/4885

“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.