SCHEMBL6089335

SCHEMBL6089335

COc1ccc(C2NC(=O)c3cccc4c3N2CCC4NC(=O)CCN2CCCCC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
MAPT P10636 2/20 0.44
ALOX15 P16050 1/20 0.44
DRD4 P21917 1/20 0.43
TSHR P16473 2/20 0.41
MEN1 O00255 1/20 0.39
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
HTT P42858 1/20 0.39
KMT2A Q03164 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
SCHEMBL6090521 0.85 ALDH1A1 (0.37) ALDH1A1DRD4TSHRMEN1LMNA
SCHEMBL6091299 0.82 LMNA (0.38) ALDH1A1MAPTDRD4TSHRLMNA
SCHEMBL16366465 0.81 KDM4E (0.41) ALDH1A1DRD4MEN1KMT2A
SCHEMBL6091583 0.77 KDM4E (0.42) ALDH1A1DRD4TSHRMEN1KMT2A
SCHEMBL6092971 0.75 KDM4E (0.42) ALDH1A1MAPTDRD4TSHRMEN1
SCHEMBL6091289 0.75 KDM4E (0.42) ALDH1A1MAPTDRD4TSHRMEN1
SCHEMBL6089125 0.75 KDM4E (0.42) ALDH1A1MAPTDRD4TSHRMEN1
SCHEMBL6089444 0.75 KDM4E (0.42) ALDH1A1MAPTDRD4TSHRMEN1
Hydrochloric Acid SCHEMBL6091722 0.74 KDM4E (0.41) ALDH1A1MAPTDRD4TSHRMEN1
SCHEMBL6091122 0.73 KDM4E (0.41) ALDH1A1MAPTDRD4TSHRMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060004028-A1 Novel PARP inhibitor MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2006-01-05 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-20060004028-A1 Novel PARP inhibitor PARP1, PARP2, PARP11 ALDH1A1 1890/4885MAPT 497/4885ALOX15 2151/4885

“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.