SCHEMBL2452107

SCHEMBL2452107

Cc1ccccc1-c1c[c]cc(-c2ccccc2C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 3/20 0.42
CA12 O43570 2/20 0.41
CA9 Q16790 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
GRIA1 P42261 1/20 0.41
CACNG8 Q8WXS5 1/20 0.41
AR P10275 1/20 0.41
MCL1 Q07820 1/20 0.41
TRPA1 O75762 1/20 0.40
CTSD P07339 1/20 0.40
BACE1 P56817 1/20 0.40
TSHR P16473 3/20 0.39
ACHE P22303 1/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
CASP3 P42574 1/20 0.39
SENP8 Q96LD8 1/20 0.39
SENP7 Q9BQF6 1/20 0.39

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
SCHEMBL19897390 0.83 TSHR (0.50) HTR7CA12CA9CA1CA2
SCHEMBL1370107 0.78 HTR7 (0.40) HTR7CA12CA9CA1CA2
SCHEMBL19577765 0.78 HTR7 (0.60) HTR7CA12CA9CA1CA2
SCHEMBL29628983 0.78 HTR7 (0.60) HTR7CA12CA9CA1CA2
SCHEMBL2453305 0.76 BACE1 (0.44) BACE1CASP3SENP8SENP7SENP6
SCHEMBL2452810 0.76 MAPT (0.40) CA9CA1CA2NPC1RAB9A
Water SCHEMBL8948779 0.75 ESR2 (0.52) HTR7CA12CA9CA1CA2
SCHEMBL29551674 0.75 CA12 (0.61) HTR7CA12CA9CA1CA2
SCHEMBL3633054 0.75 CA12 (0.61) HTR7CA12CA9CA1CA2
SCHEMBL534043 0.74 CA12 (0.47) HTR7CA12CA9CA1CA2

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-1640430-B1 Luminescent material and organic electroluminescent device using the same JNC CORP (JP) 2011-09-21 EP disclosed
EP-2177586-A1 Luminescent material and organic electroluminescent device using the same CHISSO CORPORATION (JP) 2010-04-21 EP disclosed
EP-1640430-A1 Luminescent material and organic electroluminescent device using the same CHISSO CORPORATION (JP) 2006-03-29 EP disclosed
US-20060014046-A1 Luminescent material and organic electroluminescent device using the same CHISSO CORPORATION (JP) 2006-01-19 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-20060014046-A1 Luminescent material and organic electroluminescent device using the same C1S, EPB41, EPB41L2 HTR7 3332/4885CA12 957/4885CA9 1590/4885

“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.