SCHEMBL3750168

SCHEMBL3750168

CC(C)(C)[Si](C)(C)OC[C@H]1CCC(=O)N1CC(=O)O

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 1/20 0.35
PTGER2 P43116 6/20 0.33
PTGER3 P43115 5/20 0.33
PTGDR Q13258 2/20 0.33
DUT P33316 1/20 0.33
PTGER4 P35408 3/20 0.32
TOP2A P11388 1/20 0.31
KMT2A Q03164 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
SCHEMBL28523662 1.00 FKBP1A (0.35) FKBP1APTGER2PTGER3PTGDRDUT
SCHEMBL959880 0.88 FKBP1A (0.34) FKBP1APTGER2PTGER3PTGDRDUT
SCHEMBL24795958 0.87 TP53 (0.38) FKBP1APTGER2PTGER3PTGDRDUT
SCHEMBL1401064 0.87 TP53 (0.38) FKBP1APTGER2PTGER3PTGDRDUT
SCHEMBL27650285 0.87 PTGER4 (0.39) FKBP1APTGER2PTGER3PTGER4
SCHEMBL8708692 0.86 FKBP1A (0.35) FKBP1ADUTTOP2A
SCHEMBL963144 0.85 FKBP1A (0.32) FKBP1ADUT
SCHEMBL1401084 0.83 PDK2 (0.41) FKBP1APTGER2PTGER3DUTPTGER4
SCHEMBL24795959 0.83 PDK2 (0.41) FKBP1APTGER2PTGER3DUTPTGER4
SCHEMBL1576228 0.82 DUT (0.34) FKBP1ADUTTOP2A

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
CN-112236161-A Modulators of G protein-coupled receptors 卡莫特治疗学股份有限公司 2021-01-15 CN disclosed
US-8501793-B2 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2013-08-06 US disclosed
US-7833995-B2 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2010-11-16 US disclosed
US-20070129327-A1 Blood flow promoters for cauda equina tissues ONO PHARMACEUTICAL CO., LTD. (JP) 2007-06-07 US disclosed
EP-1707208-A1 BLOOD FLOW PROMOTERS FOR CAUDA EQUINA TISSUES ONO PHARMACEUTICAL CO., LTD. (JP) 2006-10-04 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 (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-20070129327-A1 Blood flow promoters for cauda equina tissues PTGFR, PTGIS, PTGIR FKBP1A 1008/4885PTGER2 100/4885PTGER3 101/4885

“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.