SCHEMBL6903406

SCHEMBL6903406

C=CC/C1=C(C)/C=C\CCCC1.[Ru]

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 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
SCHEMBL7737256 0.74
SCHEMBL29210939 0.70 ALDH1A1 (0.43) ALDH1A1
SCHEMBL2696185 0.70 CYP3A4 (0.31) ALDH1A1
SCHEMBL9939377 0.69 ALDH1A1 (0.32) ALDH1A1
SCHEMBL861711 0.69 ALDH1A1 (0.30) ALDH1A1
SCHEMBL12641823 0.68 ALDH1A1 (0.41) ALDH1A1
SCHEMBL29210943 0.67 ALDH1A1 (0.40) ALDH1A1
SCHEMBL3344254 0.66 ALDH1A1 (0.30) ALDH1A1
SCHEMBL1048910 0.66 ALDH1A1 (0.42) ALDH1A1
SCHEMBL1048909 0.66 ALDH1A1 (0.42) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6794525-B2 USING CHIRAL DIPHOSPHINES AS OPTICALLY ACTIVE LIGANDS FOR THE PREPARATION OF DIPHOSPHINO-METAL COMPLEXES PPG-SIPSY (FR) 2004-09-21 US disclosed
US-20030195369-A1 Optically active chiral diphosphine ligands PPG-SIPSY (FR) 2003-10-16 US disclosed
EP-1305324-A1 USE OF CHIRAL DIPHOSPHINES AS OPTICALLY ACTIVE LIGANDS PPG-Sipsy (FR) 2003-05-02 EP disclosed
WO-2002012253-A1 USE OF CHIRAL DIPHOSPHINES AS OPTICALLY ACTIVE LIGANDS PPG-SIPSY (FR) 2002-02-14 WO 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-20030195369-A1 Optically active chiral diphosphine ligands NR4A1, GPR4, HTR4 ALDH1A1 1484/4885

“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.