SCHEMBL10195281

SCHEMBL10195281

CCc1ccc(Oc2cnc3ccccc3n2)cc1C1=C(O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 10/20 0.41
KMT2A Q03164 7/20 0.41
ALDH1A1 P00352 6/20 0.41
MEN1 O00255 6/20 0.41
RAB9A P51151 4/20 0.41
NPC1 O15118 4/20 0.41
ATM Q13315 2/20 0.41
HPGD P15428 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
LMNA P02545 2/20 0.40
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
CYP2C9 P11712 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
MAPT P10636 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
GLA P06280 1/20 0.39
CYP3A4 P08684 1/20 0.39
RHOA P61586 1/20 0.38

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
SCHEMBL16180987 0.90 HTT (0.37) HTTKMT2AALDH1A1MEN1RAB9A
SCHEMBL10195297 0.89 HTT (0.36) HTTKMT2AALDH1A1MEN1RAB9A
SCHEMBL10195208 0.89 TP53 (0.33) HTTKMT2AALDH1A1MEN1RAB9A
SCHEMBL10195149 0.89 CYP1A2 (0.40) HTTKMT2AALDH1A1MEN1RAB9A
SCHEMBL10195372 0.88 PTGS1 (0.37) KMT2AALDH1A1MEN1RAB9ANPC1
SCHEMBL10195447 0.85 LMNA (0.45) HTTALDH1A1RAB9AHPGDLMNA
SCHEMBL10195648 0.84 CYP1A2 (0.40) HTTKMT2AALDH1A1MEN1RAB9A
SCHEMBL10195445 0.84 PLA2G10 (0.33) ALDH1A1HPGDLMNAL3MBTL1GLA
SCHEMBL10195160 0.84 PTGS2 (0.40) L3MBTL1
SCHEMBL10195630 0.84 BRAF (0.30)

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 HTT 414/4885KMT2A 839/4885ALDH1A1 45/4885
US-20120021907-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 HTT 584/4885KMT2A 674/4885ALDH1A1 14/4885

“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.