SCHEMBL7616951

SCHEMBL7616951

O=CC1=C(C=O)CCC=C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
CA1 P00915 1/20 0.31
CA9 Q16790 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
SCHEMBL13168683 0.79
SCHEMBL7928389 0.74
SCHEMBL16588497 0.74
SCHEMBL18371404 0.74
SCHEMBL17531779 0.74
SCHEMBL25143561 0.74
SCHEMBL18892217 0.70
SCHEMBL10057888 0.70
SCHEMBL14043180 0.69
SCHEMBL14291990 0.67 TRPA1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2002527555-A 2002-08-27 JP claimed
EP-1121386-A1 HIGHLY BRANCHED OLIGOMERS, PROCESS FOR THEIR PREPARATION AND APPLICATIONS THEREOF Epox Ltd. (IL) 2001-08-08 EP claimed
WO-2000022030-A1 HIGHLY BRANCHED OLIGOMERS, PROCESS FOR THEIR PREPARATION AND APPLICATIONS THEREOF EPOX LTD. (IL) 2000-04-20 WO claimed
US-20100247439-A1 DENDRITIC NANO-ANTIOXIDANTS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-09-30 US disclosed
WO-2007117500-A2 PROCESSES FOR CHEMICAL SYNTHESIS OF LIPOCHITOOLIGOSACCHARIDES E. I. DU PONT DE NEMOURS AND COMPANY (US) 2007-10-18 WO disclosed
WO-2007001283-A2 CHEMICAL SYNTHESIS OF LOW MOLECULAR WEIGHT POLYGLUCOSAMINES AND POLYGALACTOSAMINES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2007-01-04 WO disclosed
WO-2007001282-A2 LOW MOLECULAR WEIGHT POLYGLUCOSAMINES AND POLYGALACTOSAMINES E.I. DUPONT DE NEMOURS AND COMPANY (US) 2007-01-04 WO disclosed
EP-1121386-A1 HIGHLY BRANCHED OLIGOMERS, PROCESS FOR THEIR PREPARATION AND APPLICATIONS THEREOF Epox Ltd. (IL) 2001-08-08 EP disclosed
WO-2000022030-A1 HIGHLY BRANCHED OLIGOMERS, PROCESS FOR THEIR PREPARATION AND APPLICATIONS THEREOF EPOX LTD. (IL) 2000-04-20 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-20100247439-A1 DENDRITIC NANO-ANTIOXIDANTS GPX1, GPX4, LPO ALDH1A1 235/4885CA1 3330/4885CA9 4002/4885

“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.