SCHEMBL3228143

SCHEMBL3228143

CNC1CCCCC1NS(C)(=O)=O

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.37
HCRTR2 O43614 13/20 0.35
CA1 P00915 2/20 0.34
CA12 O43570 2/20 0.34
CA7 P43166 2/20 0.34
CA14 Q9ULX7 2/20 0.34
ALDH1A1 P00352 3/20 0.33
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL4836171 0.91 POLB (0.41) POLBHCRTR2CA1CA12CA7
SCHEMBL4836161 0.91 POLB (0.41) POLBHCRTR2CA1CA12CA7
SCHEMBL4836163 0.91 POLB (0.41) POLBHCRTR2CA1CA12CA7
SCHEMBL25216432 0.83 POLB (0.36) POLBCA1CA12CA7CA14
SCHEMBL15314096 0.77 ALDH1A1 (0.45) POLBHCRTR2CA12CA7CA14
SCHEMBL145249 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL145251 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL2745491 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL113491 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL794147 0.77 ALDH1A1 (0.32) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140368573-A1 COLORING COMPOSITION, INK FOR INKJET RECORDING AND INKJET RECORDING METHOD FUJIFILM CORPORATION (JP) 2014-12-18 US disclosed
US-20100069683-A1 Organic metal compound and process for preparing optically-active alcohols using the same KANTO KAGAKU KABUSHIKI KAISHA (JP) 2010-03-18 US disclosed
US-20090062573-A1 Organic metal compound and process for preparing optically-active alcohols using the same KANTO KAGAKU KABUSHIKI KAISHA (JP) 2009-03-05 US disclosed
US-7268250-B2 Process for producing optically active compound KANTO KAGAKU KABUSHIKI KAISHA (JP) 2007-09-11 US disclosed
EP-1439159-B1 Process for producing optically active compound KANTO KAGAKU (JP) 2007-06-20 EP disclosed
US-20040176616-A1 Process for producing optically active compound KANTO KAGAKU KABUSHIKI KAISHA 2004-09-09 US disclosed
EP-1439159-A1 Process for producing optically active compound Kanto Kagaku Kabushiki Kaisha (JP) 2004-07-21 EP 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 (3 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-20090062573-A1 Organic metal compound and process for preparing optically-active alcohols using the same ADH1C, ADH1A, ADH5 POLB 890/4885HCRTR2 1684/4885CA1 661/4885
US-20040176616-A1 Process for producing optically active compound OSTC, NPEPPS, PPOX POLB 1440/4885HCRTR2 4802/4885CA1 3565/4885
US-20100069683-A1 Organic metal compound and process for preparing optically-active alcohols using the same ADH1C, ADH1A, ADH5 POLB 890/4885HCRTR2 1684/4885CA1 661/4885

“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.