SCHEMBL13243789

SCHEMBL13243789

CCc1nc(Nc2ccccc2)nc(Nc2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KCNH3 Q9ULD8 8/20 0.57
MAPT P10636 3/20 0.57
KMT2A Q03164 3/20 0.57
MEN1 O00255 2/20 0.57
GAA P10253 2/20 0.57
MAPK1 P28482 1/20 0.57
KDM4E B2RXH2 1/20 0.57
RECQL P46063 1/20 0.53
MCL1 Q07820 1/20 0.53
LMNA P02545 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
NPC1 O15118 1/20 0.53
HTT P42858 1/20 0.53
RAB9A P51151 1/20 0.53
NFKB1 P19838 1/20 0.52
ALDH1A1 P00352 1/20 0.52

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
SCHEMBL13934337 0.88 NFKB1 (0.68) KCNH3MAPTKMT2AMEN1MAPK1
SCHEMBL14264130 0.85 KCNH3 (0.51) KCNH3MAPTKMT2AMEN1GAA
SCHEMBL13852851 0.83 MAPT (0.61) KCNH3MAPTKMT2AMEN1GAA
SCHEMBL633400 0.82 MEN1 (0.77) KCNH3MAPTKMT2AMEN1GAA
SCHEMBL27498557 0.82 BCL6 (0.57) KCNH3MAPTKMT2AMEN1GAA
SCHEMBL14972625 0.81 NPC1 (0.47) MAPTKMT2AMEN1GAAKDM4E
SCHEMBL29381670 0.79 SYK (0.51) KMT2AMEN1
SCHEMBL1318576 0.79 SYK (0.51) KMT2AMEN1
SCHEMBL18123046 0.78 MEN1 (0.71) KCNH3MAPTKMT2AMEN1GAA
SCHEMBL13955864 0.78 KCNH3 (0.59) KCNH3MAPTKMT2AMEN1GAA

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
US-8147638-B2 Polarizing plate and display using the same KONICA MINOLTA OPTO INC. (JP) 2012-04-03 US disclosed
US-20110155306-A1 POLARIZING PLATE AND DISPLAY USING THE SAME KONICA MINOLTA OPTO, INC. (JP) 2011-06-30 US disclosed
US-7968019-B2 Optical compensation film, method for producing optical compensation film, polarization plate and liquid crystal display KONICA MINOLTA OPTO, INC. (JP) 2011-06-28 US disclosed
US-20100183529-A1 Cosmetic compositions comprising photostabilized dibenzoylmethane compounds and 2-pyrrolidinone-4- carboxy esters L'OREAL (FR) 2010-07-22 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-20100183529-A1 Cosmetic compositions comprising photostabilized dibenzoylmethane compounds and 2-pyrrolidinone-4- carboxy esters CYP1B1, C1S, DDT KCNH3 1894/4885MAPT 1989/4885KMT2A 1640/4885

“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.