SCHEMBL19344489

SCHEMBL19344489

CC1(C)CC(NC(=O)OCC2COC(=O)O2)CC(C)(CNC(=O)OCC2COC(=O)O2)C1

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.58
TDP1 Q9NUW8 1/20 0.32
RECQL P46063 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL679176 0.85 TSHR (0.67) TSHRTDP1
SCHEMBL19344403 0.83 ALDH1A1 (0.42) TSHR
SCHEMBL15933759 0.81 TSHR (0.70) TSHRTDP1
SCHEMBL15925795 0.79 TSHR (0.66) TSHRTDP1SMN1; SMN2
SCHEMBL15074769 0.78 TSHR (0.54) TSHRTDP1
SCHEMBL21101372 0.77 TSHR (0.57) TSHRTDP1
SCHEMBL13573771 0.77 TSHR (0.57) TSHR
SCHEMBL18419017 0.77 TSHR (0.57) TSHRTDP1RECQLSMN1; SMN2
SCHEMBL982002 0.77 TSHR (0.74) TSHRTDP1
SCHEMBL15933760 0.76 TSHR (0.52) TSHRTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3950855-A1 NON-ISOCYANATE POLYURETHANE INKS FOR 3D PRINTING 3D Systems, Incorporated (US) 2022-02-09 EP disclosed
EP-3426737-B1 NON-ISOCYANATE POLYURETHANE INKS FOR 3D PRINTING 3D SYSTEMS INCORPORATED (US) 2021-11-24 EP disclosed
US-11053191-B2 Hydroxy functional alkyl carbamate crosslinkers PPG INDUSTRIES OHIO, INC. (US) 2021-07-06 US disclosed
US-20190249033-A1 Non-Isocyanate Polyurethane Inks for 3D Printing 3D SYSTEMS, INC. 2019-08-15 US disclosed
US-20190210962-A1 HYDROXY FUNCTIONAL ALKYL CARBAMATE CROSSLINKERS PPG INDUSTRIES OHIO, INC. 2019-07-11 US disclosed
US-10316214-B2 Non-isocyanate polyurethane inks for 3D printing 3D SYSTEMS, INCORPORATED (US) 2019-06-11 US disclosed
US-20170260418-A1 Non-Isocyanate Polyurethane Inks for 3D Printing 3D SYSTEMS, INC. 2017-09-14 US disclosed
WO-2017156132-A1 NON-ISOCYANATE POLYURETHANE INKS FOR 3D PRINTING 3D SYSTEMS, INCORPORATED (US) 2017-09-14 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 (2 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-20190210962-A1 HYDROXY FUNCTIONAL ALKYL CARBAMATE CROSSLINKERS C9, JMJD6, CBR3 TSHR 2246/4885TDP1 1296/4885RECQL 612/4885
US-11053191-B2 Hydroxy functional alkyl carbamate crosslinkers C9, JMJD6, CBR3 TSHR 2246/4885TDP1 1296/4885RECQL 612/4885

“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.