SCHEMBL2457538

SCHEMBL2457538

CC(C)c1ccc(CN2C(=O)C3=C(c4cccc5ccccc45)N(Cc4ccc(C(C)C)cc4)C(=O)C3=C2c2cccc3ccccc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.42
KDM4E B2RXH2 1/20 0.40
PRKAG1 P54619 1/20 0.39
PRKAA2 P54646 1/20 0.39
PRKAB1 Q9Y478 1/20 0.39
CASP3 P42574 3/20 0.38
TP53 P04637 1/20 0.38
CES2 O00748 1/20 0.37
BCHE P06276 1/20 0.37
CES1 P23141 1/20 0.37
LMNA P02545 2/20 0.37
CYP1B1 Q16678 1/20 0.37
MEN1 O00255 1/20 0.37
RGS12 O14924 1/20 0.37
USP2 O75604 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
RECQL P46063 1/20 0.37
KMT2A Q03164 1/20 0.37
SIRT2 Q8IXJ6 1/20 0.37

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
SCHEMBL2457896 0.86 GSK3B (0.47) NPSR1KDM4ELMNAMAPTHTT
SCHEMBL2457775 0.85 NPSR1 (0.56) NPSR1KDM4ECASP3CES1LMNA
SCHEMBL6153269 0.80 GSK3B (0.45) NPSR1KDM4ELMNAMAPTHTT
SCHEMBL2457833 0.77 CYP1B1 (0.51) NPSR1KDM4ELMNACYP1B1MEN1
SCHEMBL10086968 0.72 P2RX4 (0.43) TP53LMNAMAPTHTTSIRT2
SCHEMBL6153208 0.71 RGS4 (0.47) TP53LMNAMEN1MAPTKMT2A
SCHEMBL2457350 0.71 RGS4 (0.41) LMNAMEN1KMT2ACA12CA1
SCHEMBL18974308 0.70 CES1 (0.73) CASP3TP53CES2BCHECES1
SCHEMBL6152442 0.69 POLB (0.47) KDM4ECASP3CES1LMNAMEN1
SCHEMBL12394337 0.66 POLB (0.45) KDM4ECASP3LMNAMEN1USP2

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-1341403-B1 LUMINESCENT ELEMENT MATERIAL AND LUMINESCENT ELEMENT COMPRISING THE SAME TORAY INDUSTRIES (JP) 2016-05-11 EP disclosed
EP-2365735-B1 Luminescent element material and luminescent element comprising the same TORAY INDUSTRIES (JP) 2013-08-28 EP disclosed
EP-2365735-A2 Luminescent element material and luminescent element comprising the same TORAY INDUSTRIES INC. (JP) 2011-09-14 EP disclosed
US-7318966-B2 Luminescent element material and luminescent element comprising the same TORAY INDUSTRIES, INC. (JP) 2008-01-15 US disclosed
US-20030168970-A1 Luminescent element material and luminescent element comprising the same TORAY INDUSTRIES, INC. (JP) 2003-09-11 US disclosed
EP-1341403-A1 LUMINESCENT ELEMENT MATERIAL AND LUMINESCENT ELEMENT COMPRISING THE SAME Toray Industries, Inc. (JP) 2003-09-03 EP 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-20030168970-A1 Luminescent element material and luminescent element comprising the same SAAL1, EBPL, CSNK1A1L NPSR1 1111/4885KDM4E 3225/4885PRKAG1 4668/4885

“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.