SCHEMBL18848867

SCHEMBL18848867

C=C/C=C(\C=C)P(Cl)c1ccccc1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 1/20 0.32
CYP3A4 P08684 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL21082634 0.80 AKT1 (0.34) AKT1CYP3A4TDP1
SCHEMBL12810474 0.67
SCHEMBL19807518 0.66
SCHEMBL17887361 0.65 AKT1 (0.35) AKT1CYP3A4TDP1
SCHEMBL12530984 0.63 AKT1 (0.31) AKT1
SCHEMBL29207917 0.63 CYP3A4 (0.41) AKT1CYP3A4TDP1
SCHEMBL25210883 0.63 CYP3A4 (0.36) CYP3A4TDP1
SCHEMBL433490 0.63 CES1 (0.44) CYP3A4TDP1
SCHEMBL6601507 0.61 AKT1 (0.39) AKT1CYP3A4TDP1
Vinyl Chloride SCHEMBL7901044 0.60 CYP3A4 (0.67) AKT1CYP3A4TDP1

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-20170133601-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING SAME SAMSUNG DISPLAY CO., LTD. (KR) 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-20170133601-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE INCLUDING SAME LOXL1, ELOVL1, LEF1 AKT1 4402/4885CYP3A4 456/4885TDP1 440/4885

“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.