SCHEMBL3204024

SCHEMBL3204024

CCCCC(O)OCC1CO1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.51
SMN1; SMN2 Q16637 1/20 0.48
TDP1 Q9NUW8 1/20 0.46
TSHR P16473 2/20 0.36
ENPP2 Q13822 3/20 0.35
LPAR2 Q9HBW0 2/20 0.35
MAPK1 P28482 1/20 0.33
THRB P10828 1/20 0.32

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
SCHEMBL122129 0.95 ALDH1A1 (0.49) ALDH1A1SMN1; SMN2TDP1TSHRENPP2
SCHEMBL18839942 0.93 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2TDP1ENPP2LPAR2
SCHEMBL3750987 0.93 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2TDP1ENPP2LPAR2
SCHEMBL123895 0.89 SMN1; SMN2 (0.42) ALDH1A1SMN1; SMN2TDP1TSHRENPP2
SCHEMBL28034730 0.88 TSHR (0.41) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL21327777 0.86 TSHR (0.40) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL3888232 0.83 TSHR (0.38) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL1411899 0.83 TSHR (0.38) ALDH1A1SMN1; SMN2TDP1TSHRMAPK1
SCHEMBL25211268 0.81 TSHR (0.36) ALDH1A1SMN1; SMN2TDP1TSHR
SCHEMBL636117 0.81 ALDH1A1 (0.39) ALDH1A1SMN1; SMN2TDP1TSHRENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2084289-B1 PROCESS FOR PRODUCING OF EPOXY-CONTAINING (METH)ACRYLIC ESTERS, USING LIPASES BASF SE (DE) 2015-03-04 EP disclosed
US-8183018-B2 Process for producing of epoxy-containing (meth)acrylic esters, using lipases BASF AKTIENGESELLSCHAFT (DE) 2012-05-22 US disclosed
US-20100048927-A1 PROCESS FOR PRODUCING OF EPOXY-CONTAINING (METH) ACRYLIC ESTERS, USING LIPASES BASF SE (DE) 2010-02-25 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-20100048927-A1 PROCESS FOR PRODUCING OF EPOXY-CONTAINING (METH) ACRYLIC ESTERS, USING LIPASES MGLL, ADH1A, CES2 ALDH1A1 59/4885SMN1; SMN2 3990/4885TDP1 1008/4885

“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.