SCHEMBL26548342

SCHEMBL26548342

CC1CN(Cc2ccc([N+](=O)[O-])cc2)C(=O)CN1C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.47
KCNJ1 P48048 3/20 0.46
KCNH2 Q12809 2/20 0.46
HRH3 Q9Y5N1 3/20 0.45
SIRT2 Q8IXJ6 1/20 0.42
SIRT1 Q96EB6 1/20 0.42
POLB P06746 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 3/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GBA1 P04062 1/20 0.41
ACHE P22303 1/20 0.40
HTT P42858 1/20 0.40

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
SCHEMBL26548259 0.81 ALDH1A1 (0.42) ALDH1A1LMNASMN1; SMN2HTT
SCHEMBL26134405 0.78 TDP1 (0.50) TDP1SIRT2SIRT1ALDH1A1LMNA
SCHEMBL26100484 0.77 TDP1 (0.48) TDP1KCNJ1KCNH2HRH3SIRT2
SCHEMBL26548350 0.77 HRH3 (0.46) KCNJ1KCNH2HRH3KDM4EALDH1A1
SCHEMBL23728268 0.77 KDM4E (0.48) KCNJ1KCNH2HRH3POLBKDM4E
SCHEMBL26548346 0.76 POLB (0.47) TDP1KCNJ1KCNH2HRH3POLB
SCHEMBL30361402 0.76 KCNJ1 (0.61) KCNJ1KCNH2HRH3KDM4EALDH1A1
SCHEMBL23747401 0.74 HRH3 (0.48) KCNJ1KCNH2HRH3KDM4EALDH1A1
SCHEMBL9456724 0.72 TDP1 (0.54) TDP1KCNJ1SIRT2SIRT1POLB
SCHEMBL26100782 0.72 HRH3 (0.52) KCNJ1HRH3KDM4EALDH1A1LMNA

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-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 US disclosed
US-20230133132-A1 NAMPT MODULATORS CYTOKINETICS, INC. 2023-05-04 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-20230133132-A1 NAMPT MODULATORS NAMPT, MC4R, SIRT1 TDP1 4486/4885KCNJ1 2939/4885KCNH2 3282/4885

“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.