SCHEMBL2847564

SCHEMBL2847564

CC(C)C(CC(=O)O)O[Si](C)(C)C(C)(C)C

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PGD P52209 1/20 0.32

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
SCHEMBL14993926 0.86 TDP1 (0.30) PGD
SCHEMBL14993927 0.86 TDP1 (0.30) PGD
SCHEMBL3975207 0.82
SCHEMBL4808921 0.82
SCHEMBL1155333 0.82
SCHEMBL4180699 0.81 PGD (0.33) PGD
SCHEMBL4180706 0.81 PGD (0.33) PGD
SCHEMBL4455207 0.81 PGD (0.33) PGD
SCHEMBL1155343 0.80 PGD (0.30) PGD
SCHEMBL2636857 0.79 SMN1; SMN2 (0.35) PGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2025667-B1 9,10-SECOPREGNANE DERIVATIVE AND PHARMACEUTICAL NIPPON SHINYAKU CO LTD (JP) 2016-08-10 EP disclosed
US-8796246-B2 9, 10-secopregnane derivative and pharmaceutical NIPPON SHINYAKU CO., LTD. (JP) 2014-08-05 US disclosed
US-20100130454-A1 9,10-SECOPREGNANE DERIVATIVES AND MEDICINE NIPPON SHINYAKU CO., LTD. (JP) 2010-05-27 US disclosed
US-20100016263-A1 9, 10-SECOPREGNANE DERIVATIVE AND PHARMACEUTICAL NIPPON SHINYAKU CO., LTD. (JP) 2010-01-21 US disclosed
EP-2025667-A1 9,10-SECOPREGNANE DERIVATIVE AND PHARMACEUTICAL Nippon Shinyaku Co., Ltd. (JP) 2009-02-18 EP disclosed
EP-1829860-A1 9,10-SECOPREGNANE DERIVATIVE AND MEDICINE Nippon Shinyaku Co., Ltd. (JP) 2007-09-05 EP 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-20100130454-A1 9,10-SECOPREGNANE DERIVATIVES AND MEDICINE VDR, CYP2R1, CYP24A1 PGD 2593/4885
US-20100016263-A1 9, 10-SECOPREGNANE DERIVATIVE AND PHARMACEUTICAL CYP2R1, VDR, CYP24A1 PGD 2794/4885

“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.