SCHEMBL31380929

SCHEMBL31380929

CCCC(C)CC(C)CC(C)CC(C)C=O

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL1783639 0.95 TSHR (0.40) TSHRSMN1; SMN2
SCHEMBL15337194 0.84 ADH1B (0.44) TSHRSMN1; SMN2
SCHEMBL1784305 0.82 TSHR (0.46) TSHRSMN1; SMN2
SCHEMBL1781177 0.80 ADH1B (0.44) TSHRSMN1; SMN2
SCHEMBL31365425 0.80 TSHR (0.53) TSHR
SCHEMBL29197507 0.80 TSHR (0.53) TSHR
SCHEMBL19270734 0.79 TSHR (0.33) TSHRSMN1; SMN2
SCHEMBL8704925 0.78 ADH1B (0.47) TSHRSMN1; SMN2
SCHEMBL4269680 0.77 TSHR (0.56) TSHR
SCHEMBL1781720 0.76 TSHR (0.40) TSHRSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240409480-A1 HALOALKYL ALKOXYMETHYL ETHER COMPOUND, AND PROCESS FOR PREPARING 4,6,8,10,16-PENTAMETHYLDOCOSANE THEREFROM AND FOR PREPARING SYNTHETIC INTERMEDIATE THEREFOR SHIN-ETSU CHEMICAL CO., LTD. (JP) 2024-12-12 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-20240409480-A1 HALOALKYL ALKOXYMETHYL ETHER COMPOUND, AND PROCESS FOR PREPARING 4,6,8,10,16-PENTAMETHYLDOCOSANE THEREFROM AND FOR PREPARING SYNTHETIC INTERMEDIATE THEREFOR WEE1, CYP51A1, CYP4Z1 TSHR 4093/4885SMN1; SMN2 4485/4885

“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.