SCHEMBL15060784

SCHEMBL15060784

CCOCCn1c(C=O)nc2cc(F)c(-c3ccc(F)cc3)cc21

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 4/20 0.37
KDM4E B2RXH2 2/20 0.37
HSD17B10 Q99714 1/20 0.36
MAPK14 Q16539 2/20 0.36
ALDH1A1 P00352 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
MYC P01106 1/20 0.33
PDE6A P16499 1/20 0.33
ACSS2 Q9NR19 1/20 0.32
MAPK13 O15264 1/20 0.32
MAPK12 P53778 1/20 0.32
MAPK11 Q15759 1/20 0.32
MEN1 O00255 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
ASAH1 Q13510 1/20 0.32
HSP90AA1 P07900 1/20 0.32
ATM Q13315 1/20 0.32

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
SCHEMBL12210495 0.91 KDM4E (0.38) PDE5AKDM4EHSD17B10MAPK14ALDH1A1
SCHEMBL13273928 0.90 HSP90AA1 (0.37) PDE5AKDM4EHSD17B10MAPK14ALDH1A1
SCHEMBL15061690 0.88 PDE5A (0.35) PDE5AKDM4EHSD17B10MAPK14ALDH1A1
SCHEMBL15060786 0.85 ACSS2 (0.40) KDM4EMAPK14ACSS2MEN1TSHR
SCHEMBL12210252 0.83 KDM4E (0.35) PDE5AKDM4EHSD17B10MAPK14ALDH1A1
SCHEMBL18404505 0.83 POLB (0.35) PDE5AKDM4EMAPK14ALDH1A1MAPK13
SCHEMBL15060782 0.81 KDM4E (0.35) KDM4EHSD17B10ALDH1A1SMN1; SMN2MYC
SCHEMBL13273917 0.80 PPARG (0.41) PDE5AKDM4EHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL15060788 0.80 KDM4E (0.37) PDE5AKDM4EHSD17B10MAPK14ALDH1A1
SCHEMBL15060795 0.78 MTNR1A (0.34) PDE5AKDM4EHSD17B10SMN1; SMN2MEN1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130303535-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND Sumitomo Pharma Co., Ltd. (JP) 2013-11-14 US disclosed
US-20130303535-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND Sumitomo Pharma Co., Ltd. (JP) 2013-11-14 US disclosed
US-8471038-B2 Bicyclic heterocyclic compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-06-25 US disclosed
US-8471038-B2 Bicyclic heterocyclic compound DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2013-06-25 US disclosed
US-20110294804-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-12-01 US disclosed
US-20110294804-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2011-12-01 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-20110294804-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND OPRL1, SCN1B, OPRD1 PDE5A 1986/4885KDM4E 2976/4885HSD17B10 3240/4885
US-20130303535-A1 NOVEL BICYCLIC HETEROCYCLIC COMPOUND OPRL1, SCN1B, OPRD1 PDE5A 1986/4885KDM4E 2976/4885HSD17B10 3240/4885

“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.