SCHEMBL6728043

SCHEMBL6728043

N#Cc1ccc(C(COc2ccc(C(N)=O)cc2)CC2(O)CCNCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PARP10 Q53GL7 8/20 0.47
PARP15 Q460N3 5/20 0.47
PARP2 Q9UGN5 3/20 0.47
ALDH1A1 P00352 1/20 0.38
MAPT P10636 1/20 0.38
MMP2 P08253 2/20 0.35
MMP3 P08254 1/20 0.35
CHEK2 O96017 1/20 0.35
OPRD1 P41143 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL6284254 0.74 PARP10 (0.49) PARP10PARP15PARP2ALDH1A1
SCHEMBL6629777 0.67 PARP10 (1.00) PARP10PARP15PARP2ALDH1A1MAPT
SCHEMBL322070 0.66 PARP15 (0.78) PARP10PARP15PARP2ALDH1A1MAPT
Hydrochloric Acid SCHEMBL406803 0.65 PARP15 (0.75) PARP10PARP15PARP2ALDH1A1MAPT
SCHEMBL6284574 0.65 KCNH2 (0.49) PARP10PARP15PARP2ALDH1A1
SCHEMBL28569301 0.64 PARP10 (0.75) PARP10PARP15PARP2ALDH1A1MAPT
SCHEMBL12735790 0.63 PARP10 (0.79) PARP10PARP15PARP2CHEK2
SCHEMBL13574424 0.62 MMP2 (0.63) PARP10PARP15PARP2ALDH1A1MAPT
Hydrochloric Acid SCHEMBL31752833 0.62 PARP10 (0.77) PARP10PARP15PARP2CHEK2
SCHEMBL24485238 0.62 USP2 (0.51) OPRD1

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-20040176410-A1 4-hydroxpiperdine derivative with analgetic activity MOCHIDA PHARMACEUTICAL CO., LTD. (JP) 2004-09-09 US claimed

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-20040176410-A1 4-hydroxpiperdine derivative with analgetic activity HNMT, HDAC1, HDAC3 PARP10 3017/4885PARP15 3405/4885PARP2 2833/4885

“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.