SCHEMBL2712467

SCHEMBL2712467

Fc1ccc2c(-c3c(F)c(F)c(F)c(F)c3F)c3ccccc3c(-c3ccc(F)c(F)c3)c2c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.35
CYP1A1 P04798 1/20 0.35
CYP1B1 Q16678 1/20 0.35
TOP1 P11387 1/20 0.35
PARP1 P09874 1/20 0.34
PARP3 Q9Y6F1 1/20 0.34
CCNE2 O96020 1/20 0.34
CDK4 P11802 1/20 0.34
CCND1 P24385 1/20 0.34
CCNE1 P24864 1/20 0.34
CDK2 P24941 1/20 0.34
CAMK2B Q13554 1/20 0.34
CAMK2G Q13555 1/20 0.34
CAMK2D Q13557 1/20 0.34
CAMK2A Q9UQM7 1/20 0.34
GRM5 P41594 2/20 0.33
ACHE P22303 1/20 0.33
HPGD P15428 2/20 0.32
KDM4E B2RXH2 2/20 0.32
HTT P42858 2/20 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
SCHEMBL2710674 0.94 PARP1 (0.36) PARP1PARP3GRM5DHODHESR1
SCHEMBL2713293 0.92 CYP1A2 (0.35) CYP1A2CYP1A1CYP1B1TOP1PARP1
SCHEMBL12086052 0.92 CYP1A2 (0.39) CYP1A2CYP1A1CYP1B1TOP1PARP1
SCHEMBL2710417 0.90 CYP1A1 (0.35) CYP1A2CYP1A1CYP1B1TOP1KDM4E
SCHEMBL2712693 0.90 CYP1A1 (0.37) CYP1A2CYP1A1CYP1B1TOP1ACHE
SCHEMBL2711696 0.89 CCNE2 (0.38) CYP1A2CYP1A1CYP1B1TOP1PARP1
SCHEMBL2712783 0.89 TRPA1 (0.33) CYP1A2CYP1A1CYP1B1TOP1PARP1
SCHEMBL12086160 0.89 TRPA1 (0.33) CYP1A2CYP1A1CYP1B1TOP1PARP1
SCHEMBL2709236 0.88 TUBB4A (0.37) PARP1PARP3L3MBTL1DHODH
SCHEMBL12086171 0.87 LMNA (0.36) CYP1A2PARP1CCNE2CDK4CCND1

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
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
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
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 CYP1A2 22/4885CYP1A1 5/4885CYP1B1 7/4885

“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.