SCHEMBL7076394

SCHEMBL7076394

CC(C)n1c(C(N)=O)c(N2CCC(Cc3ccccc3)CC2)c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
MAPT P10636 3/20 0.45
KDM4E B2RXH2 2/20 0.45
GAA P10253 1/20 0.45
POLB P06746 1/20 0.44
HTR7 P34969 4/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
APOBEC3A P31941 1/20 0.43
APOBEC3G Q9HC16 1/20 0.43
ALDH1A1 P00352 2/20 0.42
HTT P42858 2/20 0.42
GFER P55789 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42

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
SCHEMBL7076384 0.82 MAPT (0.47) KCNH2MAPTKDM4EGAAHTR7
SCHEMBL5732389 0.74 GAA (0.50) KCNH2HRH3GAA
SCHEMBL5377677 0.74 GAA (0.50) KCNH2HRH3GAA
SCHEMBL7078851 0.71 MEN1 (0.52) MAPTKDM4EGAAMEN1KMT2A
SCHEMBL5733944 0.71 KCNH2 (0.43) KCNH2HRH3MAPTGAAPOLB
SCHEMBL6429862 0.69 GAA (0.60) KCNH2MAPTGAAHTTGFER
SCHEMBL6428994 0.68 GAA (0.70) MAPTKDM4EGAAMEN1KMT2A
SCHEMBL7076381 0.67 SIGMAR1 (0.48) KCNH2HRH3POLBMEN1KMT2A
SCHEMBL23410008 0.67 NR3C1 (0.47) MAPTKDM4EHTR7ALDH1A1HTT
SCHEMBL29980507 0.67 NR3C1 (0.47) MAPTKDM4EHTR7ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030073699-A1 Compounds and methods to treat cardiac failure and other disorders SCIOS, INC. 2003-04-17 US disclosed
US-6130235-A PIPERIDINE MOIETIES COUPLED TO INDOLE, BENZIMIDAZOLE OR BENZOTRIAZOLE. SCIOS INC. (US) 2000-10-10 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-20030073699-A1 Compounds and methods to treat cardiac failure and other disorders RCOR1, NR3C2, CNR1 KCNH2 1160/4885HRH3 555/4885MAPT 3270/4885

“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.