SCHEMBL16707883

SCHEMBL16707883

CO[Si](C)(C)CCCOCC(O)CN1CCOCC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
USP2 O75604 3/20 0.47
ALDH1A1 P00352 2/20 0.46
TSHR P16473 3/20 0.46
HTT P42858 1/20 0.46
L3MBTL1 Q9Y468 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
KDM4E B2RXH2 1/20 0.41
ALOX15 P16050 1/20 0.41
GAA P10253 2/20 0.41
CYP2D6 P10635 1/20 0.41
MAPK1 P28482 1/20 0.41
POLB P06746 1/20 0.41
ADRB2 P07550 1/20 0.41
ADRB1 P08588 1/20 0.41
ADRB3 P13945 1/20 0.41
KMT2A Q03164 2/20 0.40
MEN1 O00255 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL12153680 0.89 ALDH1A1 (0.49) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL17880401 0.85 ALDH1A1 (0.36) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL22354571 0.84 USP2 (0.62) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL1245084 0.83 USP2 (0.46) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL12153682 0.82 ALDH1A1 (0.43) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL15536318 0.82 USP2 (0.45) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL12761114 0.81 USP2 (0.59) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL20487113 0.81 USP2 (0.67) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL13394456 0.80 ALDH1A1 (0.40) USP2ALDH1A1TSHRHTTL3MBTL1
SCHEMBL12153683 0.80 KDM4E (0.47) USP2ALDH1A1TSHRHTTL3MBTL1

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-9925521-B2 Chromatographic materials WATERS TECHNOLOGIES CORPORATION (US) 2018-03-27 US disclosed
US-20150133294-A1 CHROMATOGRAPHIC MATERIALS WATERS TECHNOLOGIES CORPORATION (US) 2015-05-14 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-20150133294-A1 CHROMATOGRAPHIC MATERIALS HAX1, CXCR1, YBX1 USP2 2648/4885ALDH1A1 1859/4885TSHR 2306/4885

“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.