SCHEMBL14720769

SCHEMBL14720769

CCOC(=O)COc1cc(NC(=O)C(F)(F)F)ccc1C#Cc1cc(CBr)nc(CBr)c1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
IDH1 O75874 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GLA P06280 1/20 0.35
CXCR1 P25024 1/20 0.34
CXCR2 P25025 1/20 0.34
MAPT P10636 2/20 0.33
MAPK1 P28482 1/20 0.33
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
IDO1 P14902 1/20 0.33
TDO2 P48775 1/20 0.33
NPY5R Q15761 1/20 0.32
AR P10275 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
SCHEMBL14720545 0.92 CYP1A2 (0.40) CYP1A2CYP2C9CYP2C19IDH1SMN1; SMN2
SCHEMBL14721808 0.83 CYP1A2 (0.31) CYP1A2CYP2C9CYP2C19IDH1LMNA
SCHEMBL14720963 0.83 CYP1A2 (0.44) CYP1A2CYP2C9CYP2C19IDH1SMN1; SMN2
SCHEMBL15189372 0.81 MAPK1 (0.34) KDM4EGLAMAPTMAPK1LMNA
SCHEMBL14721349 0.80 CYP1A2 (0.47) CYP1A2CYP2C9CYP2C19IDH1SMN1; SMN2
SCHEMBL18674503 0.79
SCHEMBL14721142 0.77 CYP1A2 (0.50) CYP1A2CYP2C9CYP2C19IDH1SMN1; SMN2
SCHEMBL14721257 0.77 CYP2C19 (0.42) CYP1A2CYP2C9CYP2C19SMN1; SMN2KDM4E
SCHEMBL19529554 0.76 PDK1 (0.41) CYP1A2CYP2C9CYP2C19SMN1; SMN2MAPT
SCHEMBL19531606 0.76 HPGD (0.40) CYP1A2CYP2C9CYP2C19SMN1; SMN2KDM4E

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-2753674-B1 LUMINESCENT LANTHANIDE CHELATES HAVING THREE CHROMOPHORES AND THEIR USE DHR FINLAND OY (FI) 2016-02-10 EP disclosed
US-20130210165-A1 Luminescent Lanthanide Chelates Having Three Chromophores and Their Use DHR FINLAND OY (FI) 2013-08-15 US disclosed
WO-2013026790-A9 LUMINESCENT LANTHANIDE CHELATES HAVING THREE CHROMOPHORES AND THEIR USE DHR FINLAND OY (FI) 2013-05-23 WO disclosed
WO-2013026790-A1 LUMINESCENT LANTHANIDE CHELATES HAVING THREE CHROMOPHORES AND THEIR USE DHR FINLAND OY (FI) 2013-02-28 WO 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-20130210165-A1 Luminescent Lanthanide Chelates Having Three Chromophores and Their Use GLB1, SSB, LGALS3BP CYP1A2 3913/4885CYP2C9 3265/4885CYP2C19 3971/4885

“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.