SCHEMBL10195342

SCHEMBL10195342

CCc1ccc(Oc2ccc([N+](=O)[O-])cc2Cl)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.47
KDM4E B2RXH2 1/20 0.46
LMNA P02545 4/20 0.45
NPSR1 Q6W5P4 2/20 0.45
HSP90AA1 P07900 1/20 0.45
PDE7A Q13946 1/20 0.45
KMT2A Q03164 6/20 0.45
MEN1 O00255 5/20 0.45
GAA P10253 1/20 0.45
PKM P14618 1/20 0.45
MAPT P10636 7/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
GPR55 Q9Y2T6 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
POLB P06746 1/20 0.36
MAPK1 P28482 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
RAB9A P51151 1/20 0.36
HPGD P15428 1/20 0.36

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 0.90 ALDH1A1 (0.45) ALDH1A1KDM4ELMNANPSR1HSP90AA1
SCHEMBL10195046 0.89 HSPB1 (0.42) ALDH1A1KDM4ELMNANPSR1HSP90AA1
SCHEMBL10195097 0.88 HTR2A (0.39) LMNAHSP90AA1MAPTTDP1HPGD
SCHEMBL10195334 0.87 POLB (0.42) ALDH1A1KDM4ENPSR1HSP90AA1KMT2A
SCHEMBL16181151 0.87 HTR2A (0.36) ALDH1A1KDM4ELMNANPSR1HSP90AA1
SCHEMBL10195339 0.86 CYP1A2 (0.44) ALDH1A1KDM4ELMNANPSR1HSP90AA1
SCHEMBL10195343 0.86 ESRRA (0.38) ALDH1A1KDM4ELMNANPSR1HSP90AA1
SCHEMBL10195376 0.86 PDE7A (0.44) ALDH1A1KDM4ELMNAPDE7AKMT2A
SCHEMBL10195115 0.86 SLC6A4 (0.41) POLB
SCHEMBL10195077 0.86 HTR2A (0.36) ALDH1A1KDM4ELMNAKMT2AMEN1

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 ALDH1A1 45/4885KDM4E 712/4885LMNA 4151/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ALDH1A1 14/4885KDM4E 1092/4885LMNA 4657/4885

“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.