SCHEMBL4926243

SCHEMBL4926243

CCCCCCCCCCCCCCCCOC(CC)OC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.47
CA1 P00915 8/20 0.39
CA2 P00918 8/20 0.39
CA9 Q16790 7/20 0.39
CA12 O43570 3/20 0.39
CA7 P43166 3/20 0.39
CA14 Q9ULX7 3/20 0.39
CA3 P07451 2/20 0.39
CA4 P22748 2/20 0.39
CA6 P23280 2/20 0.39
CA5A P35218 2/20 0.39
CA5B Q9Y2D0 2/20 0.39
PRKD3 O94806 1/20 0.38
PRKCG P05129 1/20 0.38
PRKCB P05771 1/20 0.38
PRKCA P17252 1/20 0.38
PRKCH P24723 1/20 0.38
PRKCI P41743 1/20 0.38
PRKCE Q02156 1/20 0.38
PRKCQ Q04759 1/20 0.38

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
SCHEMBL15384178 1.00 DNM1 (0.47) DNM1CA1CA2CA9CA12
SCHEMBL26986860 0.91 ADRB2 (0.36) DNM1CA1CA2TSHR
SCHEMBL438937 0.91 ADRB2 (0.36) DNM1CA1CA2TSHR
SCHEMBL13038625 0.88 DNM1 (0.52) DNM1CA1CA2CA9CA12
SCHEMBL27058279 0.88 DNM1 (0.52) DNM1CA1CA2CA9CA12
SCHEMBL24562854 0.88 DNM1 (0.52) DNM1CA1CA2CA9CA12
SCHEMBL28878262 0.88 DNM1 (0.52) DNM1CA1CA2CA9CA12
SCHEMBL14836599 0.84 DNM1 (0.48) DNM1CA1CA2CA9CA12
SCHEMBL27433788 0.83 DNM1 (0.44) DNM1CA1CA2CA9CA12
SCHEMBL27835501 0.82 DNM1 (0.47) DNM1CA1CA2CA9CA12

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-20080071084-A1 Using an alcohol in presence of copper catalyst and ligand ARCHIMICA GMBH (DE) 2008-03-20 US claimed
US-20080071084-A1 Using an alcohol in presence of copper catalyst and ligand ARCHIMICA GMBH (DE) 2008-03-20 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-20080071084-A1 Using an alcohol in presence of copper catalyst and ligand NR1H3, NR1H2, ADH1A DNM1 2704/4885CA1 900/4885CA2 3567/4885

“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.