SCHEMBL10249227

SCHEMBL10249227

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.37
PTGS2 P35354 4/20 0.36
PTGS1 P23219 1/20 0.36
POLB P06746 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
AKT1 P31749 2/20 0.34
AKT2 P31751 2/20 0.34
BRD4 O60885 1/20 0.34
PFKFB3 Q16875 1/20 0.33
SLC40A1 Q9NP59 1/20 0.32
HSD11B1 P28845 1/20 0.32
ATM Q13315 1/20 0.32
PDE2A O00408 1/20 0.31
F10 P00742 1/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31
CYP17A1 P05093 1/20 0.31
LMNA P02545 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
SCHEMBL10249218 0.89 CA12 (0.40) PDE10AAKT1AKT2CA12CA1
SCHEMBL10249278 0.89 PDE10A (0.36) PDE10APTGS2PTGS1POLBSMN1; SMN2
SCHEMBL10249250 0.88 PDE10A (0.38) PDE10APTGS2PTGS1POLBSMN1; SMN2
SCHEMBL10249035 0.87 BRD4 (0.36) PDE10APOLBSMN1; SMN2AKT1AKT2
SCHEMBL116514 0.85 POLB (0.41) PDE10APTGS2PTGS1POLBPDE2A
SCHEMBL15426257 0.85 HSD11B1 (0.47) PDE10AAKT1AKT2BRD4HSD11B1
SCHEMBL4403186 0.82 PDE10A (0.40) PDE10APOLBSMN1; SMN2AKT1AKT2
SCHEMBL10248950 0.81 SMN1; SMN2 (0.43) PDE10APTGS2POLBSMN1; SMN2ATM
SCHEMBL16803686 0.81 PDE10A (0.38) PDE10APOLBSMN1; SMN2AKT1AKT2
SCHEMBL10249224 0.80 PDE10A (0.40) PDE10APOLBSMN1; SMN2AKT1AKT2

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 PDE10A 4112/4885PTGS2 2157/4885PTGS1 1400/4885
US-20120015975-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF C3AR1, C9, C5 PDE10A 4112/4885PTGS2 2157/4885PTGS1 1400/4885

“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.