SCHEMBL10249218

SCHEMBL10249218

Cc1cnc2c(c1)nc(-c1ccncc1S(N)(=O)=O)n2C

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CA12 O43570 17/20 0.40
CA2 P00918 17/20 0.40
CA9 Q16790 17/20 0.40
CA1 P00915 16/20 0.40
CA14 Q9ULX7 11/20 0.40
LMNA P02545 1/20 0.39
PDE10A Q9Y233 1/20 0.36
AKT1 P31749 1/20 0.35
AKT2 P31751 1/20 0.35

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
SCHEMBL10249227 0.89 PDE10A (0.37) CA12CA2CA9CA1LMNA
SCHEMBL10249278 0.88 PDE10A (0.36) CA12CA2CA9CA1PDE10A
SCHEMBL10249250 0.87 PDE10A (0.38) CA12CA2CA9CA1CA14
SCHEMBL10249035 0.86 BRD4 (0.36) PDE10AAKT1AKT2
SCHEMBL10284733 0.85 PTGS2 (0.42) CA12CA2CA9CA1CA14
SCHEMBL10249307 0.81 PDE10A (0.38) LMNAPDE10AAKT1AKT2
SCHEMBL4403186 0.81 PDE10A (0.40) PDE10AAKT1AKT2
SCHEMBL16803686 0.80 PDE10A (0.38) LMNAPDE10AAKT1AKT2
SCHEMBL10249224 0.79 PDE10A (0.40) LMNAPDE10AAKT1AKT2
SCHEMBL10248903 0.79 POLB (0.38) PDE10AAKT1AKT2

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
US-8461181-B2 Fused heterocyclic compound and use thereof SUMITOMO CHEMICAL COMPANY, LTD. (JP) 2013-06-11 US disclosed
US-8273764-B2 Fused heterocyclic compounds and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-09-25 US disclosed
US-20120178779-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED 2012-07-12 US disclosed
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-19 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 (2 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-20120178779-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 CA12 3308/4885CA2 3296/4885CA9 3380/4885
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 CA12 3308/4885CA2 3296/4885CA9 3380/4885

“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.