SCHEMBL20901035

SCHEMBL20901035

C=C(C)C(=O)NCC(C)OC

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
MTNR1A P48039 6/20 0.38
MTNR1B P49286 6/20 0.38
TGFBR1 P36897 1/20 0.36
TSHR P16473 1/20 0.35
RXFP1 Q9HBX9 1/20 0.33
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 1/20 0.31
MAPT P10636 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
SCHEMBL29518890 0.86 TSHR (0.33) ALDH1A1MTNR1AMTNR1BTGFBR1TSHR
SCHEMBL29519446 0.86 TSHR (0.33) ALDH1A1MTNR1AMTNR1BTGFBR1TSHR
SCHEMBL24513273 0.86 TGFBR1 (0.37) ALDH1A1MTNR1AMTNR1BTGFBR1TSHR
SCHEMBL10162451 0.83 MTNR1A (0.40) ALDH1A1MTNR1AMTNR1BCYP2D6CYP2C19
SCHEMBL16805864 0.82 TSHR (0.38) ALDH1A1MTNR1AMTNR1BTGFBR1TSHR
SCHEMBL136474 0.82 ALDH1A1 (0.39) ALDH1A1TGFBR1TSHRRXFP1KDM4E
SCHEMBL553719 0.81 ALDH1A1 (0.35) ALDH1A1TGFBR1TSHRRXFP1
SCHEMBL27373187 0.79 TGFBR1 (0.33) ALDH1A1MTNR1AMTNR1BTGFBR1TSHR
SCHEMBL366427 0.79 CYP2D6 (0.52) ALDH1A1TGFBR1TSHRRXFP1CYP2D6
SCHEMBL12737210 0.78 TGFBR1 (0.36) ALDH1A1MTNR1AMTNR1BTGFBR1TSHR

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
CN-115279851-B Hyperbranched polyester polyol suitable for organic solvent-based two-component polyurethane coating compositions 巴斯夫欧洲公司 2024-07-19 CN disclosed
CN-116635445-A Polyester polyols comprising isosorbide, isoidide or isomannide derived units 巴斯夫欧洲公司 2023-08-22 CN disclosed
CN-116615479-A Polyester polyols comprising 2, 5-bis (hydroxymethyl) tetrahydrofuran 巴斯夫欧洲公司 2023-08-18 CN disclosed
CN-115279851-A Hyperbranched polyester polyol suitable for organic solvent-based two-component polyurethane coating compositions 巴斯夫欧洲公司 2022-11-01 CN disclosed
EP-3099739-B1 PARAMAGNETIC SUPPORTS FOR USE AS ASSAY REAGENTS SIEMENS HEALTHCARE DIAGNOSTICS INC (US) 2019-07-10 EP disclosed
US-10259969-B2 Paramagnetic supports for use as assay reagents SIEMENS HEALTHCARE DIAGNOSTICS INC. (US) 2019-04-16 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-10259969-B2 Paramagnetic supports for use as assay reagents PUF60, MAG, HMBS ALDH1A1 4340/4885MTNR1A 4761/4885MTNR1B 4749/4885

“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.