SCHEMBL18927201

SCHEMBL18927201

C=C(C)C(=O)OCCC1(S)CCCCC1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
TSHR P16473 3/20 0.42
ALDH1A1 P00352 2/20 0.38
POLB P06746 1/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 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
SCHEMBL960865 0.79 THRB (0.42) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL60085 0.78 THRB (0.65) THRBTSHRALDH1A1POLBAPEX1
Cyclohexane SCHEMBL117214 0.78 THRB (0.65) THRBTSHRALDH1A1POLBAPEX1
Cyclopentane SCHEMBL2397167 0.78 THRB (0.65) THRBTSHRALDH1A1POLBAPEX1
Cyclopropane SCHEMBL420362 0.78 THRB (0.65) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL148593 0.78 THRB (0.41) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL153853 0.78 THRB (0.41) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL28481187 0.76 THRB (0.40) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL936916 0.75 THRB (0.42) THRBTSHRALDH1A1POLBAPEX1
SCHEMBL27501921 0.75 TSHR (0.49) THRBTSHRALDH1A1POLBAPEX1

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
US-10285914-B2 Bonding method, bonding kit, and bonding material TOKUYAMA DENTAL CORPORATION (JP) 2019-05-14 US disclosed
US-20170156991-A1 BONDING METHOD, BONDING KIT, AND BONDING MATERIAL TOKUYAMA DENTAL CORPORATION (JP) 2017-06-08 US disclosed
US-20170156991-A1 BONDING METHOD, BONDING KIT, AND BONDING MATERIAL TOKUYAMA DENTAL CORPORATION (JP) 2017-06-08 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 (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-10285914-B2 Bonding method, bonding kit, and bonding material SUV39H1, SUV39H2, EZH1 THRB 3991/4885TSHR 4547/4885ALDH1A1 946/4885
US-20170156991-A1 BONDING METHOD, BONDING KIT, AND BONDING MATERIAL SUV39H1, SUV39H2, EZH1 THRB 3991/4885TSHR 4547/4885ALDH1A1 946/4885

“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.