SCHEMBL12428451

SCHEMBL12428451

O=C(O)C1=NN(c2ccccc2)C(=O)/C1=C\c1ccc(-c2ccc(-c3ccc4c(c3)CCCN4c3ccc(-c4ccccc4)cc3)cc2)s1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 2/20 0.38
EP300 Q09472 3/20 0.37
HDAC6 Q9UBN7 1/20 0.37
CREBBP Q92793 1/20 0.36
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
KAT8 Q9H7Z6 3/20 0.34
MCL1 Q07820 1/20 0.34
SRD5A1 P18405 1/20 0.33

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
SCHEMBL12428249 0.93 EP300 (0.41) SCN9AEP300HDAC6CREBBPKDM4E
SCHEMBL12428261 0.91 EP300 (0.40) SCN9AEP300HDAC6CREBBPKDM4E
SCHEMBL12428264 0.91 EP300 (0.40) SCN9AEP300HDAC6CREBBPKDM4E
SCHEMBL12428430 0.89 SCN9A (0.42) SCN9AEP300HDAC6CREBBPKDM4E
SCHEMBL12428447 0.86 MEN1 (0.42) SCN9AKDM4EMEN1ALDH1A1MAPT
SCHEMBL12428446 0.86 MEN1 (0.42) SCN9AKDM4EMEN1ALDH1A1MAPT
SCHEMBL12428117 0.86 ALDH1A1 (0.44) SCN9AKDM4EMEN1ALDH1A1MAPT
SCHEMBL12428169 0.86 ALDH1A1 (0.44) SCN9AKDM4EMEN1ALDH1A1MAPT
SCHEMBL12428432 0.85 KAT8 (0.45) EP300HDAC6KDM4EMEN1ALDH1A1
SCHEMBL12428177 0.83 KMT2A (0.43) KDM4EMEN1ALDH1A1MAPTHPGD

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-7977570-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed
US-7977570-B2 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2011-07-12 US disclosed
US-20090084441-A1 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-04-02 US disclosed
US-20090084441-A1 Dye-sensitized photoelectric conversion device NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2009-04-02 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-20090084441-A1 Dye-sensitized photoelectric conversion device CRY1, H1-5, H1-0 SCN9A 175/4885EP300 2442/4885HDAC6 4236/4885

“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.