SCHEMBL2394929

SCHEMBL2394929

CCCCCCCCNNS(N)(=O)=O

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.52
CA2 P00918 12/20 0.50
CA1 P00915 11/20 0.50
EPHX1 P07099 2/20 0.42
CA9 Q16790 7/20 0.42
CA12 O43570 3/20 0.42
CA7 P43166 3/20 0.42
CA14 Q9ULX7 3/20 0.42
CA3 P07451 2/20 0.42
CA4 P22748 2/20 0.42
CA6 P23280 2/20 0.42
CA5A P35218 2/20 0.42
CA5B Q9Y2D0 2/20 0.42

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
SCHEMBL11314889 0.98 CA2 (0.52) PPARACA2CA1EPHX1CA9
SCHEMBL7205612 0.91 CA2 (0.60) PPARACA2CA1CA9CA12
SCHEMBL7205609 0.81
SCHEMBL12469021 0.80 CA1 (0.50) PPARACA2CA1EPHX1
SCHEMBL3275563 0.78 PPARA (0.47) PPARACA2CA1EPHX1CA9
SCHEMBL3794668 0.77 CA2 (0.82) PPARACA2CA1EPHX1CA9
SCHEMBL4622863 0.77 CA2 (0.82) PPARACA2CA1EPHX1CA9
SCHEMBL1228645 0.77 CA2 (0.82) PPARACA2CA1EPHX1CA9
SCHEMBL3124345 0.77 CA2 (0.82) PPARACA2CA1EPHX1CA9
SCHEMBL291897 0.77 CA2 (0.82) PPARACA2CA1EPHX1CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8569513-B2 Compound having a triptycene moiety FUJIFILM CORPORATION (JP) 2013-10-29 US disclosed
US-20110237804-A1 COMPOUND HAVING A TRIPTYCENE MOIETY FUJIFILM CORPORATION (JP) 2011-09-29 US disclosed
US-7697095-B2 Liquid crystal display device FUJIFILM CORPORATION (JP) 2010-04-13 US disclosed
US-20100072437-A1 COMPOSITION, COLOR FILTER AND PROCESS FOR PREPARING COLOR FILTER FUJIFILM CORPORATION (JP) 2010-03-25 US disclosed
US-20080137014-A1 Liquid Crystal Display Device FUJIFILM CORPORATION (JP) 2008-06-12 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-20110237804-A1 COMPOUND HAVING A TRIPTYCENE MOIETY CHRM1, H1-2, H1-0 PPARA 1835/4885CA2 480/4885CA1 148/4885

“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.