SCHEMBL2726046

SCHEMBL2726046

Fc1ccc2c(-c3ccc(F)c(F)c3)c3c(F)c(F)c(F)c(F)c3c(-c3ccc(F)c(F)c3)c2c1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.36
PARP3 Q9Y6F1 1/20 0.36
GRM5 P41594 2/20 0.35
ESR1 P03372 1/20 0.32
IKBKB O14920 1/20 0.32
CHUK O15111 1/20 0.32
AKT1 P31749 1/20 0.32
AKT2 P31751 1/20 0.32
AKT3 Q9Y243 1/20 0.32
NOTUM Q6P988 1/20 0.32
CA3 P07451 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31
TRPA1 O75762 2/20 0.31
IDO1 P14902 1/20 0.31
CCNE2 O96020 1/20 0.31
CDK4 P11802 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
SCHEMBL2710027 0.95 PARP1 (0.34) PARP1PARP3GRM5ESR1IKBKB
SCHEMBL2725679 0.95 PARP1 (0.34) PARP1PARP3GRM5ESR1IKBKB
SCHEMBL2711712 0.92 PARP1 (0.33) PARP1PARP3GRM5
SCHEMBL2726294 0.92 LMNA (0.35) PARP1PARP3GRM5CCNE2CDK4
SCHEMBL12086190 0.92 LMNA (0.35) PARP1PARP3GRM5CCNE2CDK4
SCHEMBL2724755 0.91 PARP1 (0.33) PARP1PARP3GRM5
SCHEMBL2726690 0.89 PARP1 (0.38) PARP1PARP3GRM5ESR1IKBKB
SCHEMBL2726934 0.89 PARP1 (0.34) PARP1PARP3GRM5ESR1IKBKB
SCHEMBL12086091 0.87 MEN1 (0.42) ESR1MAPK13MAPK12MAPK11MAPK14
SCHEMBL2712297 0.87 MEN1 (0.42) ESR1MAPK13MAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2445987-B1 BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS CYALUME TECH INC (US) 2018-05-02 EP disclosed
EP-2445987-B1 BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS CYALUME TECH INC (US) 2018-05-02 EP disclosed
US-8257620-B2 Blue/violet diphenylanthracene chemiluminescent fluorescers CYALUME TECHNOLOGIES, INC. (US) 2012-09-04 US disclosed
US-8257620-B2 Blue/violet diphenylanthracene chemiluminescent fluorescers CYALUME TECHNOLOGIES, INC. (US) 2012-09-04 US disclosed
EP-2445987-A1 BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS Cyalume Technologies, Inc (US) 2012-05-02 EP disclosed
US-20100327240-A1 Blue/violet diphenylanthracene chemiluminescent fluorescers CYALUME TECHNOLOGIES, INC. 2010-12-30 US disclosed
US-20100327240-A1 Blue/violet diphenylanthracene chemiluminescent fluorescers CYALUME TECHNOLOGIES, INC. 2010-12-30 US disclosed
WO-2010151654-A1 BLUE/VIOLET DIPHENYLANTHRACENE CHEMILUMINESCENT FLUORESCERS CYALUME TECHNOLOGIES, INC. (US) 2010-12-29 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-20100327240-A1 Blue/violet diphenylanthracene chemiluminescent fluorescers CYP2F1, FLAD1, AFF1 PARP1 1159/4885PARP3 729/4885GRM5 3861/4885

“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.