SCHEMBL20005877

SCHEMBL20005877

CC1(COCCCCCCCCO)COC1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.43
MEN1 O00255 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
GAA P10253 1/20 0.33

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
SCHEMBL14653044 0.98 EPHX1 (0.45) EPHX1MEN1THRBHTTKMT2A
SCHEMBL13672217 0.92 EPHX1 (0.46) EPHX1
SCHEMBL12677064 0.90 EPHX1 (0.41) EPHX1
SCHEMBL8831467 0.90 EPHX1 (0.41) EPHX1
SCHEMBL8831115 0.88 EPHX1 (0.42) EPHX1
SCHEMBL3525307 0.84 EPHX1 (0.50) EPHX1MEN1THRBHTTKMT2A
SCHEMBL17474268 0.83 ALDH1A1 (0.43) EPHX1MEN1THRBHTTKMT2A
SCHEMBL2623192 0.83 EPHX1 (0.35) EPHX1HTT
SCHEMBL2623182 0.83 ALDH1A1 (0.43) EPHX1MEN1THRBHTTKMT2A
SCHEMBL10071389 0.83 EPHX1 (0.35) EPHX1

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-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT IDEMITSU KOSAN CO., LTD (JP) 2018-03-29 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-20180090687-A1 CROSS-CONJUGATED POLYMER, MATERIAL FOR ELECTRONIC ELEMENT, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, AND ORGANIC ELECTROLUMINESCENT ELEMENT SLC18A1, SLC1A2, SLC43A1 EPHX1 753/4885MEN1 4059/4885THRB 4371/4885

“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.