SCHEMBL10359751

SCHEMBL10359751

C=CC(=O)NC(C)CC[N+](C)(C)C

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.50
ACACB O00763 2/20 0.36
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2C19 P33261 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31

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
Bromide SCHEMBL6116803 0.98 TSHR (0.48) TSHRACACBALDH1A1MAPK1TDP1
Hydrochloric Acid SCHEMBL7906759 0.98 TSHR (0.48) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL4838458 0.83 TSHR (0.47) TSHRACACBALDH1A1MAPK1TDP1
Hydrochloric Acid SCHEMBL6117844 0.83 TSHR (0.44) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL2140805 0.81 TSHR (0.54) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL21829097 0.80 TSHR (0.44) TSHRALDH1A1MAPK1TDP1CYP2C19
Hydrochloric Acid SCHEMBL1483412 0.79 TSHR (0.52) TSHRACACBALDH1A1MAPK1TDP1
Water SCHEMBL31228205 0.79 TSHR (0.52) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL8366347 0.79 TSHR (0.56) TSHRACACBALDH1A1MAPK1TDP1
SCHEMBL325416 0.79 TSHR (0.56) TSHRACACBALDH1A1MAPK1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0274189-B1 RIBOFLAVIN/FLUORESCENT LIGHT-INITIATED POLYMERIZATION OF WATER-SOLUBLE MONOMERS CALGON CORPORATION (US) 1990-12-27 EP claimed
EP-0274189-A1 Riboflavin/fluorescent light-initiated polymerization of water-soluble monomers CALGON CORPORATION (US) 1988-07-13 EP claimed
EP-3344234-B1 POLYMERS AND MICROSPHERES BIOCOMPATIBLES UK LTD (GB) 2021-11-24 EP disclosed
CN-110257188-B Liquid for lens, contact lens, and method for producing same JSR株式会社 2021-05-04 CN disclosed
US-20180250230-A1 POLYMERS AND MICROSPHERES BIOCOMPATIBLES UK LIMITED (GB) 2018-09-06 US disclosed
EP-3344234-A1 POLYMERS AND MICROSPHERES Biocompatibles UK Limited (GB) 2018-07-11 EP disclosed
WO-2017037276-A1 POLYMERS AND MICROSPHERES BIOCOMPATIBLES UK LIMITED (GB) 2017-03-09 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-20180250230-A1 POLYMERS AND MICROSPHERES INHA, CD68, NES TSHR 2467/4885ACACB 2408/4885ALDH1A1 2120/4885

“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.