SCHEMBL405714

SCHEMBL405714

CCc1cc(O)ccc1C1C(=O)C(C)(C)OC(C)(C)C1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.39
DPP4 P27487 1/20 0.39
HSD17B3 P37058 2/20 0.39
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
LMNA P02545 2/20 0.37
ALDH1A1 P00352 2/20 0.37
MAPK1 P28482 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
NPC1 O15118 1/20 0.37
USP2 O75604 1/20 0.37
TP53 P04637 1/20 0.37
GAA P10253 1/20 0.37
PKM P14618 1/20 0.37
HPGD P15428 1/20 0.37
ALOX15 P16050 1/20 0.37
ALOX12 P18054 1/20 0.37
AGTR1 P30556 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL417363 0.89 HSD17B3 (0.38) ANPEPDPP4HSD17B3MAPTKDM4E
SCHEMBL402954 0.83 TSHR (0.40) MAPTLMNAALDH1A1MAPK1TP53
SCHEMBL3658384 0.75 TSHR (0.36) LMNAALDH1A1MAPK1HPGDSMN1; SMN2
SCHEMBL410941 0.74 LMNA (0.38) MAPTLMNAALDH1A1MAPK1TP53
SCHEMBL10192890 0.74 ANPEP (0.38) ANPEPDPP4HSD17B3MAPTKDM4E
SCHEMBL406720 0.72 CTSD (0.40) MAPTALDH1A1GAAHPGDKMT2A
SCHEMBL3661847 0.72 TSHR (0.36) LMNAALDH1A1MAPK1HPGDSMN1; SMN2
SCHEMBL3654462 0.72 LMNA (0.34) MAPTLMNAALDH1A1MAPK1TP53
SCHEMBL3656740 0.71 TSHR (0.36) LMNAALDH1A1MAPK1HPGDSMN1; SMN2
SCHEMBL3018579 0.71 HTR1A (0.32) ALDH1A1TP53HTR2BTMEM97SIGMAR1

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
US-9102642-B2 Herbicidally active cyclic diones and derivatives thereof, processes for their preparation, compositions, and methods of controlling weeds SYNGENTA LIMITED (GB) 2015-08-11 US disclosed
EP-2393796-B1 NOVEL HERBICIDES SYNGENTA LTD (GB) 2015-02-25 EP disclosed
US-20120021909-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
EP-2393796-A1 NOVEL HERBICIDES Syngenta Limited (GB) 2011-12-14 EP disclosed
WO-2010089211-A1 NOVEL HERBICIDES SYNGENTA LIMITED (GB) 2010-08-12 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 (1 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-20120021909-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ANPEP 1236/4885DPP4 49/4885HSD17B3 497/4885

“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.