SCHEMBL16579348

SCHEMBL16579348

COC(=O)[C@H]1CCC(CO[Si](C)(C)C(C)(C)C)N(C)C1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
BRD4 O60885 1/20 0.33
PDK1 Q15118 1/20 0.32
FKBP1A P62942 1/20 0.31
ALDH1A1 P00352 1/20 0.31
OPRK1 P41145 1/20 0.31
TP53 P04637 1/20 0.31
GAA P10253 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
SCHEMBL17961794 1.00 SMN1; SMN2 (0.34) SMN1; SMN2BRD4PDK1FKBP1AALDH1A1
SCHEMBL16579389 1.00 SMN1; SMN2 (0.34) SMN1; SMN2BRD4PDK1FKBP1AALDH1A1
SCHEMBL17961792 1.00 SMN1; SMN2 (0.34) SMN1; SMN2BRD4PDK1FKBP1AALDH1A1
SCHEMBL17972863 0.86 FKBP1A (0.30) FKBP1A
SCHEMBL15878168 0.81 OPRK1 (0.34) SMN1; SMN2OPRK1
SCHEMBL20943538 0.81 OPRK1 (0.34) SMN1; SMN2OPRK1
SCHEMBL15878165 0.81 OPRK1 (0.34) SMN1; SMN2OPRK1
SCHEMBL15878162 0.81 OPRK1 (0.34) SMN1; SMN2OPRK1
SCHEMBL1700418 0.77 SMN1; SMN2 (0.39) SMN1; SMN2FKBP1AALDH1A1TP53GAA
SCHEMBL1147987 0.77 SMN1; SMN2 (0.39) SMN1; SMN2FKBP1AALDH1A1TP53GAA

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-20160221948-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-04 US disclosed
WO-2015037716-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND 住友化学株式会社 (JP) 2015-03-19 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-20160221948-A1 NITROGEN-CONTAINING SATURATED HETEROCYCLIC COMPOUND H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, H1-4, HRH4 SMN1; SMN2 1489/4885BRD4 69/4885PDK1 4217/4885

“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.