SCHEMBL6915054

SCHEMBL6915054

C=Cc1cc(C=C)c2c(C=C)ccc(C=C)c2c1C=C

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL21471146 0.81 ALDH1A1 (0.41) ALDH1A1
SCHEMBL27458633 0.75 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5241695 0.72 ALDH1A1 (0.39) ALDH1A1
SCHEMBL29623714 0.72 ALDH1A1 (0.39) ALDH1A1
SCHEMBL27870229 0.69 PDXK (0.31)
SCHEMBL8734517 0.69 ALDH1A1 (0.40) ALDH1A1
SCHEMBL30475683 0.69 ALDH1A1 (0.40) ALDH1A1
SCHEMBL959915 0.67 ALDH1A1 (0.38) ALDH1A1
SCHEMBL28361776 0.67 ALDH1A1 (0.38) ALDH1A1
SCHEMBL29279392 0.65 SLC22A8 (0.30)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6686504-B2 COMPLEX POLYMERIZATION CATALYST THE GOODYEAR TIRE & RUBBER COMPANY 2004-02-03 US disclosed
US-20020035294-A1 Synthesis of soluble functionalized lithium initiators GOODYEAR TIRE & RUBBER COMPANY, THE 2002-03-21 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-20020035294-A1 Synthesis of soluble functionalized lithium initiators KDM5B, KDM2B, KDM5A ALDH1A1 265/4885

“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.