SCHEMBL2646686

SCHEMBL2646686

CS(=O)(=O)c1ccncc1O

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 9/20 0.42
CA2 P00918 9/20 0.42
CA9 Q16790 9/20 0.42
CA1 P00915 8/20 0.42
CA14 Q9ULX7 8/20 0.42
PTGS2 P35354 1/20 0.38
LMNA P02545 2/20 0.37
POLB P06746 1/20 0.37
DAO P14920 2/20 0.37
ERN1 O75460 1/20 0.37
SLC22A12 Q96S37 1/20 0.36

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
SCHEMBL30014737 0.81 CA12 (0.55) CA12CA2CA9CA1CA14
SCHEMBL30508939 0.81 NAPRT (0.45) CA12CA2CA9CA1CA14
SCHEMBL30014015 0.79 FTO (0.46) CA12CA2CA9CA1CA14
SCHEMBL2646684 0.77 CA12 (0.39) CA12CA2CA9CA1CA14
SCHEMBL19144940 0.77 L3MBTL1 (0.44) CA12CA2CA9CA1CA14
SCHEMBL23665029 0.75 CA12 (0.38) CA12CA2CA9CA1CA14
SCHEMBL30050575 0.75 KDM4E (0.47) CA12CA2CA9CA1CA14
SCHEMBL21768460 0.75 CA12 (0.43) CA12CA2CA9CA1CA14
SCHEMBL30784405 0.75 PTGS2 (0.42) CA12CA2CA9CA1CA14
SCHEMBL18230499 0.75 KDM4E (0.47) CA12CA2CA9CA1CA14

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-1702919-B1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE MSD KK (JP) 2012-05-30 EP disclosed
US-7728025-B2 2-heteroaryl-substituted benzimidazole derivative BANYU PHARMACEUTICAL CO., LTD. (JP) 2010-06-01 US disclosed
US-20080070928-A1 Novel 2-Heteroaryl-Substituted Benzimidazole Derivative MSD K.K. (JP) 2008-03-20 US disclosed
EP-1702919-A1 NOVEL 2-HETEROARYL-SUBSTITUTED BENZIMIDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2006-09-20 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 (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-20080070928-A1 Novel 2-Heteroaryl-Substituted Benzimidazole Derivative GCK, GCKR, HK1 CA12 3942/4885CA2 893/4885CA9 2989/4885

“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.