SCHEMBL2239732

SCHEMBL2239732

C=C(CCCC)C(=O)OC.[SiH3]O[SiH3]

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CES1 P23141 6/20 0.41
CES2 O00748 5/20 0.41
ALDH1A1 P00352 3/20 0.39
TP53 P04637 1/20 0.38
TSHR P16473 3/20 0.37
CA1 P00915 2/20 0.37
EPHX1 P07099 1/20 0.35
CA2 P00918 1/20 0.34
POLB P06746 1/20 0.34
POLA1 P09884 1/20 0.34
CA12 O43570 1/20 0.34
CA14 Q9ULX7 1/20 0.34
AKR1B1 P15121 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
SCHEMBL1298659 0.96 CES1 (0.44) CES1CES2ALDH1A1TP53TSHR
SCHEMBL10579259 0.94 TSHR (0.42) CES1CES2ALDH1A1TP53TSHR
Ethylene SCHEMBL9299137 0.94 CES1 (0.42) CES1CES2ALDH1A1TP53TSHR
Acetic Acid SCHEMBL28135566 0.90 ALDH1A1 (0.43) CES1CES2ALDH1A1TP53TSHR
SCHEMBL689956 0.89 CES2 (0.46) CES1CES2ALDH1A1TSHRPOLB
SCHEMBL25178527 0.88 CES2 (0.48) CES1CES2ALDH1A1TSHRPOLB
SCHEMBL3503494 0.88 CES2 (0.48) CES1CES2ALDH1A1TSHRPOLB
SCHEMBL7999274 0.88 CES2 (0.48) CES1CES2ALDH1A1TSHRPOLB
Water SCHEMBL7997185 0.88 CES2 (0.44) CES1CES2ALDH1A1TSHRPOLB
SCHEMBL25375939 0.88 CES2 (0.48) CES1CES2ALDH1A1TSHRPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110190467-A1 Biological Polysiloxanes VISION CRC LIMITED (AU) 2011-08-04 US disclosed
US-20090276042-A1 Biological Polysiloxanes VISION CRC LIMITED (AU) 2009-11-05 US disclosed
EP-2021399-A1 BIOLOGICAL POLYSILOXANES VISION CRC LIMITED (AU) 2009-02-11 EP disclosed
WO-2007128051-A1 BIOLOGICAL POLYSILOXANES VISION CRC LIMITED (AU) 2007-11-15 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-20090276042-A1 Biological Polysiloxanes PBK, B2M, CD79B CES1 3864/4885CES2 4206/4885ALDH1A1 4364/4885

“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.