SCHEMBL879008

SCHEMBL879008

Cc1ccc(/C(=C/c2cc(O)c(/C=C(\c3ccccc3)c3ccc(C)cc3)cc2O)c2ccccc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 3/20 0.49
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
ESR1 P03372 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
POLB P06746 2/20 0.39
LMNA P02545 1/20 0.39
MAPT P10636 2/20 0.38
KCNMA1 Q12791 1/20 0.38
CYP19A1 P11511 1/20 0.38
CYP11B2 P19099 1/20 0.38
ALDH1A1 P00352 2/20 0.38
CYP1B1 Q16678 1/20 0.38
CYP3A4 P08684 1/20 0.38
HPGD P15428 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL14628466 0.88 PTGS2 (0.41) PTGS2CES2CES1NPC1RAB9A
SCHEMBL9026535 0.77 PTGS2 (0.73) PTGS2CES2CES1ESR1NPC1
SCHEMBL29222532 0.77 PTGS2 (0.68) PTGS2CES2CES1ESR1NPC1
SCHEMBL9026538 0.77 PTGS2 (0.73) PTGS2CES2CES1ESR1NPC1
SCHEMBL5848427 0.75 PTGS2 (0.44) PTGS2CES2CES1ESR1MEN1
SCHEMBL9806382 0.75 PTGS2 (0.70) PTGS2CES2CES1ESR1NPC1
SCHEMBL18394568 0.75 PTGS2 (0.42) PTGS2CES2CES1NPC1RAB9A
P-Cresol SCHEMBL27763965 0.73 ESR1 (0.75) PTGS2CES2CES1ESR1NPC1
SCHEMBL3850013 0.72 CES2 (0.56) PTGS2CES2CES1NPC1RAB9A
SCHEMBL3850015 0.72 CES2 (0.56) PTGS2CES2CES1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8142908-B2 Polymer light-emitting material comprising a conjugated polymer and compound exhibiting light emission from the triplet excited state and polymer light-emitting device using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-03-27 US disclosed
US-8012603-B2 Polyanilines; strong fluorescence and large charge transporting properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-09-06 US disclosed
US-20080138651-A1 Polyanilines; strong fluorescence and large charge transporting properties SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-06-12 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 (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-20080138651-A1 Polyanilines; strong fluorescence and large charge transporting properties BRS3, SLC43A1, MRPS23 PTGS2 3298/4885CES2 3062/4885CES1 4057/4885

“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.