SCHEMBL85840

SCHEMBL85840

CC=CC(=O)NCCCCCNC(C)=O

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.64
MAPK1 P28482 1/20 0.64
HIF1A Q16665 1/20 0.64
PAOX Q6QHF9 3/20 0.53
ADRA1A P35348 1/20 0.52
APEX1 P27695 1/20 0.47
ZDHHC20 Q5W0Z9 3/20 0.44
ZDHHC2 Q9UIJ5 3/20 0.44
EGFR P00533 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PYGL P06737 1/20 0.38
NAMPT P43490 1/20 0.38

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
SCHEMBL22187118 0.92 APEX1 (0.51) KDM4EMAPK1HIF1AAPEX1ZDHHC20
SCHEMBL21610956 0.85 APEX1 (0.49) KDM4EMAPK1HIF1AAPEX1ZDHHC20
SCHEMBL113308 0.84 APEX1 (0.47) KDM4EMAPK1HIF1AAPEX1ZDHHC20
SCHEMBL19363595 0.84 ZDHHC20 (0.63) APEX1ZDHHC20ZDHHC2EGFR
SCHEMBL8511129 0.84 ZDHHC20 (0.63) APEX1ZDHHC20ZDHHC2EGFR
SCHEMBL13314418 0.84 APEX1 (0.47) KDM4EMAPK1HIF1AAPEX1ZDHHC20
SCHEMBL21731701 0.84 ZDHHC20 (0.63) APEX1ZDHHC20ZDHHC2EGFR
SCHEMBL108156 0.82 PAOX (0.57) KDM4EMAPK1HIF1APAOXAPEX1
SCHEMBL13314415 0.82 PAOX (0.57) KDM4EMAPK1HIF1APAOXAPEX1
SCHEMBL7532607 0.82 ZDHHC20 (0.60) APEX1ZDHHC20ZDHHC2EGFRMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8129529-B2 UV excitable fluorescent energy transfer dyes APPLIED BIOSYSTEMS, LLC (US) 2012-03-06 US disclosed
US-20110077415-A1 UV Excitable Fluorescent Energy Transfer Dyes Life Technologies Corporation (US) 2011-03-31 US disclosed
US-7888507-B2 UV excitable fluorescent energy transfer dyes APPLIED BIOSYSTEMS, LLC 2011-02-15 US disclosed
US-7550570-B2 Labeling nucleotide sequences with rhodamine dye APPLIED BIOSYSTEMS, LLC. (US) 2009-06-23 US disclosed
US-20090093623-A1 4,7-DICHLORORHODAMINE DYES APPLIED BIOSYSTEMS INC. (US) 2009-04-09 US disclosed
US-20090062543-A1 UV EXCITABLE FLUORESCENT ENERGY TRANSFER DYES APPLIED BIOSYSTEMS INC. (US) 2009-03-05 US disclosed
US-20090031506-A1 UV Excitable Fluorescent Energy Transfer Dyes APPLERA CORPORATION (US) 2009-02-05 US disclosed
US-7402671-B2 UV excitable fluorescent energy transfer dyes APPLERA CORPORATION (US) 2008-07-22 US disclosed
US-7378517-B2 UV excitable energy transfer reagents APPLERA CORPORATION (US) 2008-05-27 US disclosed
US-7179906-B2 Asymmetric benzoxanthene dyes APPLERA CORPORATION (US) 2007-02-20 US disclosed
US-7169939-B2 Energy transfer dyes with enhanced fluorescence APPLERA CORPORATION (US) 2007-01-30 US disclosed
US-7157572-B2 UV excitable energy transfer reagents APPLERA CORPORATION (US) 2007-01-02 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 (3 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-20090062543-A1 UV EXCITABLE FLUORESCENT ENERGY TRANSFER DYES SLC46A1, SLC43A3, SLC25A4 KDM4E 3624/4885MAPK1 3417/4885HIF1A 3329/4885
US-20090093623-A1 4,7-DICHLORORHODAMINE DYES POLL, FPR3, DRD4 KDM4E 1350/4885MAPK1 3651/4885HIF1A 2854/4885
US-20110077415-A1 UV Excitable Fluorescent Energy Transfer Dyes SLC46A1, SLC43A3, SLC25A4 KDM4E 3624/4885MAPK1 3417/4885HIF1A 3329/4885

“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.