SCHEMBL2927161

SCHEMBL2927161

Cc1cc(Br)ccc1S(=O)(=O)NCCN1CCCC1

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.64
SIGMAR1 Q99720 6/20 0.63
SMN1; SMN2 Q16637 1/20 0.55
CA1 P00915 1/20 0.53
CA2 P00918 1/20 0.53
SLC2A1 P11166 3/20 0.51
L3MBTL1 Q9Y468 3/20 0.50
TSHR P16473 2/20 0.47
ALOX15 P16050 1/20 0.47
MBTD1 Q05BQ5 1/20 0.47
ALDH1A1 P00352 1/20 0.46

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
SCHEMBL1409464 0.89 SMN1; SMN2 (0.70) POLBSMN1; SMN2L3MBTL1TSHRALDH1A1
SCHEMBL2933630 0.84 SIGMAR1 (0.63) POLBSIGMAR1SMN1; SMN2SLC2A1L3MBTL1
SCHEMBL20248784 0.78 POLB (0.96) POLBSIGMAR1SMN1; SMN2L3MBTL1TSHR
SCHEMBL270734 0.77 SIGMAR1 (1.00) POLBSIGMAR1SMN1; SMN2L3MBTL1TSHR
SCHEMBL30309662 0.77 CA1 (0.61) SMN1; SMN2CA1CA2ALDH1A1
SCHEMBL16735334 0.77 CA1 (0.61) SMN1; SMN2CA1CA2ALDH1A1
SCHEMBL19869958 0.76 GAA (0.61) POLBSIGMAR1SMN1; SMN2CA1CA2
SCHEMBL16118202 0.76 CA1 (0.59) POLBSMN1; SMN2CA1CA2TSHR
SCHEMBL2498510 0.76 L3MBTL1 (0.81) POLBSIGMAR1SMN1; SMN2L3MBTL1TSHR
SCHEMBL16098346 0.75 CA1 (0.66) SMN1; SMN2CA1CA2ALDH1A1

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
EP-2044051-B1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB PUBL (SE) 2010-01-27 EP disclosed
EP-2044051-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (publ) (SE) 2009-04-08 EP disclosed
US-20080039450-A1 Compounds BIOVITRUM AB (PUBL.) (SE) 2008-02-14 US disclosed
WO-2007147874-A1 PYRIDINE AND PYRAZINE DERIVATIVES AS MNK KINASE INHIBITORS BIOVITRUM AB (PUBL) (SE) 2007-12-27 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-20080039450-A1 Compounds NEK2, CSNK2A3, CSNK2A1 POLB 1721/4885SIGMAR1 1647/4885SMN1; SMN2 567/4885

“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.