SCHEMBL6295869

SCHEMBL6295869

C=CC[C@@H]1C(=O)OC[C@@H]1O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 2/20 0.41
CTRC Q99895 2/20 0.41
F2 P00734 1/20 0.41
CYP19A1 P11511 2/20 0.35
ELANE P08246 1/20 0.34
CTSG P08311 1/20 0.34
MEN1 O00255 1/20 0.33
ALDH1A1 P00352 1/20 0.33
KMT2A Q03164 1/20 0.33
PTPN1 P18031 2/20 0.32
CYP3A4 P08684 2/20 0.31
CYP2D6 P10635 1/20 0.31
SLC6A2 P23975 1/20 0.31
SLC6A1 P30531 1/20 0.31
SLC6A3 Q01959 1/20 0.31
SHBG P04278 1/20 0.31
FAAH O00519 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
SCHEMBL6427222 1.00 PRSS1 (0.41) PRSS1CTRCF2CYP19A1ELANE
SCHEMBL7053913 1.00 PRSS1 (0.41) PRSS1CTRCF2CYP19A1ELANE
SCHEMBL6427227 1.00 PRSS1 (0.41) PRSS1CTRCF2CYP19A1ELANE
SCHEMBL9616924 0.81 F2 (0.42) PRSS1CTRCF2ELANECTSG
SCHEMBL2845072 0.80 PRSS1 (0.38) PRSS1CTRCF2CYP19A1ELANE
SCHEMBL14601491 0.79 PRSS1 (0.37) PRSS1CTRCF2ELANECTSG
SCHEMBL14149503 0.74
SCHEMBL14113498 0.74
SCHEMBL16318869 0.74
SCHEMBL18239488 0.73 MEN1 (0.36) PRSS1CTRCF2CYP19A1MEN1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6897324-B2 Process for the preparation of 11-oxaprostaglandins and intermediates therein CHIROTECH TECHNOLOGY LIMITED (GB) 2005-05-24 US disclosed
US-20030166948-A1 Process for the preparation of 11-oxaprostaglandins and intermediates therein CHIROTECH TECHNOLOGY LIMITED (GB) 2003-09-04 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 (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-20030166948-A1 Process for the preparation of 11-oxaprostaglandins and intermediates therein CYP4A11, PTGER1, PTGIS PRSS1 1347/4885CTRC 4264/4885F2 188/4885

“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.