SCHEMBL1477667

SCHEMBL1477667

C=Cc1ccc2c(c1)C(C)(C)c1ccccc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.41
ALK Q9UM73 1/20 0.39
MLNR O43193 1/20 0.38
NR1I2 O75469 1/20 0.38
CHRM2 P08172 1/20 0.38
ADRB1 P08588 1/20 0.38
HTR1A P08908 1/20 0.38
ADRA2A P08913 1/20 0.38
CHRM1 P11229 1/20 0.38
DRD2 P14416 1/20 0.38
ADRA2B P18089 1/20 0.38
ADRA2C P18825 1/20 0.38
CHRM3 P20309 1/20 0.38
DRD1 P21728 1/20 0.38
SLC6A2 P23975 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
SLC6A4 P31645 1/20 0.38
ADRA1A P35348 1/20 0.38
HRH1 P35367 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
SCHEMBL17201467 0.91 ALK (0.43) PDK2ALKTP53TDP1ALDH1A1
SCHEMBL28426241 0.89 MLNR (0.38) PDK2ALKMLNRNR1I2CHRM2
SCHEMBL2602496 0.83 PDK2 (0.37) PDK2ALKMLNRNR1I2CHRM2
SCHEMBL10052204 0.83 PDK2 (0.41) PDK2ALK
SCHEMBL3557265 0.82 PDK2 (0.41) PDK2MLNRNR1I2CHRM2ADRB1
SCHEMBL14427937 0.82 ALK (0.41) ALKTP53TDP1ALDH1A1TSHR
SCHEMBL12925457 0.81 PDK2 (0.36) PDK2MLNRNR1I2CHRM2ADRB1
SCHEMBL2602462 0.81 PDK2 (0.39) PDK2MLNRNR1I2CHRM2ADRB1
SCHEMBL24742475 0.81 PDK2 (0.40) PDK2ALKHTR2AHTR2CTP53
SCHEMBL14913959 0.81 PDK2 (0.32) PDK2ALKMLNRNR1I2CHRM2

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
CN-103804658-A Polymerizable polyfluorene macromonomer and synthesis method thereof UNIV ZHEJIANG 2014-05-21 CN disclosed
US-7914907-B2 Light-emitting device CANON KABUSHIKI KAISHA (JP) 2011-03-29 US disclosed
US-7663301-B2 for use as robust red organic phosphors GENERAL ELECTRIC COMPANY (US) 2010-02-16 US disclosed
US-20070184302-A1 Light-emitting device CANON KABUSHIKI KAISHA (JP) 2007-08-09 US disclosed
EP-1787338-A1 LIGHT-EMITTING DEVICE Canon Kabushiki Kaisha (JP) 2007-05-23 EP disclosed
WO-2006076247-A2 PHOSPHORESCENT FLUORENE, ANTHRACENE AND/OR THIOPHENE SUBSTITUTED METALLO- PORPHYRINS AND RELATED COMPOUNDS GENERAL ELECTRIC COMPANY (US) 2006-07-20 WO disclosed
US-20060152149-A1 Porphyrin compositions GENERAL ELECTRIC COMPANY (US) 2006-07-13 US disclosed
WO-2006035640-A1 LIGHT-EMITTING DEVICE CANON KABUSHIKI KAISHA (JP) 2006-04-06 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-20060152149-A1 Porphyrin compositions ACP1, MMS19, MVD PDK2 1743/4885ALK 1511/4885MLNR 2590/4885

“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.