SCHEMBL7937781

SCHEMBL7937781

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

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.38
CYP4A11 Q02928 2/20 0.38
LMNA P02545 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 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
SCHEMBL16124356 1.00 CYP4F2 (0.38) CYP4F2CYP4A11LMNAALDH1A1HSD17B10
SCHEMBL13264348 1.00 CYP4F2 (0.38) CYP4F2CYP4A11LMNAALDH1A1HSD17B10
SCHEMBL2632363 0.98 CYP4F2 (0.35) CYP4F2CYP4A11LMNAALDH1A1HSD17B10
SCHEMBL91152 0.95 SMN1; SMN2 (0.35) CYP4F2CYP4A11LMNAALDH1A1HSD17B10
SCHEMBL19480944 0.91 CYP4F2 (0.32) CYP4F2CYP4A11TDP1
SCHEMBL15386615 0.81 GGPS1 (0.40) TSHR
SCHEMBL11993646 0.81 GGPS1 (0.40) TSHR
SCHEMBL14580411 0.81 GGPS1 (0.40) TSHR
SCHEMBL17251187 0.79
SCHEMBL16124355 0.79

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
US-9796664-B2 Compositions including 6-aminohexanoic acid derivatives as HDAC inhibitors BIOMARIN PHARMACEUTICAL INC. (US) 2017-10-24 US disclosed
US-20160122290-A1 COMPOSITIONS INCLUDING 6-AMINOHEXANOIC ACID DERIVATIVES AS HDAC INHIBITORS REPLIGEN CORPORATION 2016-05-05 US disclosed
WO-2014181000-A1 PRODUCTION OF MYXOPYRONIN AND OF ITS DERIVATIVES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2014-11-13 WO disclosed
EP-2457893-A1 Intermediates for macrocyclic modulators of the ghrelin receptor Tranzyme Pharma, Inc. (US) 2012-05-30 EP disclosed
EP-2457925-A1 Process for preparing a macrocyclic modulator of the ghrelin receptor and intermediates Tranzyme Pharma, Inc. (US) 2012-05-30 EP disclosed
WO-2010028192-A1 COMPOSITIONS INCLUDING 6-AMINOHEXANOIC ACID DERIVATIVES AS HDAC INHIBITORS REPLIGEN CORPORATION (US) 2010-03-11 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-20160122290-A1 COMPOSITIONS INCLUDING 6-AMINOHEXANOIC ACID DERIVATIVES AS HDAC INHIBITORS HDAC1, HDAC5, HDAC2 CYP4F2 3030/4885CYP4A11 2877/4885LMNA 2827/4885

“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.