SCHEMBL18842007

SCHEMBL18842007

C=C(C)c1ccc(C(C)(C)OC(C)(C)C(C)(C)O)cc1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.32
NPSR1 Q6W5P4 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
SCHEMBL10484418 0.81 ALDH1A1 (0.54) ALDH1A1ALOX15TSHRNPSR1
SCHEMBL18842170 0.80 TSHR (0.32) TSHR
SCHEMBL6563424 0.74 TSHR (0.37) TSHRNPSR1
SCHEMBL9545770 0.74 MAPK1 (0.43) ALDH1A1ALOX15TSHR
SCHEMBL18841947 0.74 TSHR (0.34) TSHRNPSR1
SCHEMBL18842041 0.72 TSHR (0.31) TSHR
SCHEMBL9471595 0.72 SLC2A1 (0.44) TSHR
SCHEMBL11281234 0.72 ESR1 (0.43) ALDH1A1TSHRNPSR1
SCHEMBL465848 0.72 TSHR (0.52) ALDH1A1TSHR
SCHEMBL1646807 0.71 ESR1 (0.34) ALDH1A1ALOX15TSHRNPSR1

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-20170131635-A1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2017-05-11 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-20170131635-A1 MONOMER, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS H1-2, H1-0, H1-4 ALDH1A1 2580/4885ALOX15 1271/4885TSHR 3867/4885

“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.