SCHEMBL13833775

SCHEMBL13833775

CC(=O)Nc1ccc2c(c1-c1nc3ccccc3s1)CCNC2

nearest known ligand 0.67

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 11/20 0.67
UHRF1 Q96T88 2/20 0.54
MYC P01106 2/20 0.49
KDM4E B2RXH2 1/20 0.49
POLB P06746 1/20 0.48
MAPT P10636 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
TP53 P04637 1/20 0.48
USP2 O75604 1/20 0.46
ATM Q13315 1/20 0.46

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
Trifluoroacetic Acid SCHEMBL14778261 0.94 UHRF1 (0.64) APEX1UHRF1MYCKDM4EPOLB
SCHEMBL13833744 0.81 APEX1 (0.61) APEX1UHRF1MYCKDM4EMAPT
SCHEMBL13735036 0.80 APEX1 (1.00) APEX1UHRF1MYCKDM4EPOLB
SCHEMBL13833708 0.80 APEX1 (0.56) APEX1UHRF1KDM4EPOLBMAPT
SCHEMBL13833774 0.80 APEX1 (0.56) APEX1UHRF1KDM4EPOLBMAPT
SCHEMBL14788045 0.78 APEX1 (0.85) APEX1UHRF1MYCKDM4EPOLB
Hydrochloric Acid SCHEMBL14777450 0.78 APEX1 (0.83) APEX1UHRF1MYCKDM4EPOLB
Trifluoroacetic Acid SCHEMBL14777866 0.75 UHRF1 (0.90) APEX1UHRF1MYCKDM4EPOLB
SCHEMBL13833686 0.75 APEX1 (0.51) APEX1UHRF1KDM4EPOLBMAPT
SCHEMBL13833863 0.75 APEX1 (0.89) APEX1UHRF1MYCKDM4EPOLB

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-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. 2013-03-21 US disclosed
WO-2012154888-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS PROTEOSTASIS THERAPEUTICS, INC. (US) 2012-11-15 WO 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-20130072473-A1 COMPOUNDS FOR TREATING PROTEIN FOLDING DISORDERS HSPA5, PSMG3, VCP APEX1 2669/4885UHRF1 3008/4885MYC 3701/4885

“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.