SCHEMBL10196022

SCHEMBL10196022

CCc1ccc(O)cc1C1=C(O)C2C(C1=O)[C@H]1CC[C@@H]2CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.36
DPP4 P27487 1/20 0.36
JAK2 O60674 2/20 0.33
JAK1 P23458 2/20 0.33
TYK2 P29597 2/20 0.33
JAK3 P52333 2/20 0.33
HSD17B3 P37058 1/20 0.33
CYP26A1 O43174 4/20 0.32
ESR1 P03372 3/20 0.32
ESR2 Q92731 3/20 0.32
CYP19A1 P11511 1/20 0.32
OPRM1 P35372 2/20 0.32
OPRK1 P41145 2/20 0.32
MAOA P21397 1/20 0.32
UGT1A1 P22309 1/20 0.32
MAOB P27338 1/20 0.32
OPRD1 P41143 1/20 0.32
CHEK1 O14757 1/20 0.31
WEE1 P30291 1/20 0.31
PBRM1 Q86U86 1/20 0.31

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
SCHEMBL19070623 1.00 ANPEP (0.36) ANPEPDPP4JAK2JAK1TYK2
SCHEMBL19071228 0.95 SLC6A2 (0.36) ANPEPDPP4JAK2JAK1TYK2
SCHEMBL10196011 0.95 SLC6A2 (0.36) ANPEPDPP4JAK2JAK1TYK2
SCHEMBL19070946 0.89 EDNRB (0.37) PBRM1
SCHEMBL432544 0.89 EDNRB (0.37) PBRM1
SCHEMBL10196030 0.89 EDNRB (0.37) PBRM1
SCHEMBL432171 0.84 ALDH1A1 (0.33)
SCHEMBL10196014 0.84 ALDH1A1 (0.33)
SCHEMBL16256604 0.84 CYP24A1 (0.40) CYP26A1CYP19A1
SCHEMBL19070860 0.84 ANPEP (0.35) ANPEPDPP4JAK2JAK1TYK2

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-2389066-B1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LTD (GB) 2017-07-05 EP disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-8895474-B2 Herbicidally active cyclopentanediones and derivatives thereof, and their use in controlling weeds SYNGENTA LIMITED (GB) 2014-11-25 US disclosed
US-20120021912-A1 NOVEL HERBICIDES SYNGENTA CROP PROTECTION LLC (US) 2012-01-26 US disclosed
WO-2010102848-A1 CYCLOPENTADIONE DERIVED HERBICIDES SYNGENTA LIMITED (GB) 2010-09-16 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-20120021912-A1 NOVEL HERBICIDES DDT, CYP4X1, CYP1B1 ANPEP 1236/4885DPP4 49/4885JAK2 3390/4885

“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.