SCHEMBL10195635

SCHEMBL10195635

CC1(C)OC(C)(C)C(O)=C(c2cc(Oc3ccc([N+](=O)[O-])c(Cl)c3)ccc2C2CC2)C1=O

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
DNMT3B Q9UBC3 4/20 0.33
TDP1 Q9NUW8 2/20 0.32
MAPK1 P28482 2/20 0.32
MAPT P10636 2/20 0.32
CYP2C9 P11712 2/20 0.31
CYP2C19 P33261 2/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2D6 P10635 1/20 0.30
HTT P42858 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
GPR55 Q9Y2T6 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL16181208 0.87 DRD2 (0.32)
SCHEMBL10195620 0.86 SOS1 (0.34)
SCHEMBL10195606 0.85 MAOB (0.37) MAPK1LMNAMEN1KMT2A
SCHEMBL10195020 0.85 LMNA (0.33) TDP1MAPK1MAPTCYP2C9CYP2C19
SCHEMBL10195607 0.84 CHRNA3 (0.34) TDP1MAPTCYP2C9CYP2C19CYP1A2
SCHEMBL10195631 0.83 AR (0.38)
SCHEMBL10195633 0.83 MRGPRX4 (0.32)
SCHEMBL16351667 0.83 BRAF (0.31)
SCHEMBL16351647 0.82 KDM4E (0.44) TDP1MAPK1MAPTCYP2C9LMNA
SCHEMBL10195611 0.81 MAOB (0.39) LMNAHTTNPSR1

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 5 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-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
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 DNMT3B 2089/4885TDP1 1306/4885MAPK1 2927/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 DNMT3B 2709/4885TDP1 1576/4885MAPK1 2263/4885

“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.