SCHEMBL7580735

SCHEMBL7580735

CC1=C(C#N)C(c2ccc(Cl)c([N+](=O)[O-])c2)C2=C(CCNC2=O)N1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.43
KDM4E B2RXH2 9/20 0.43
GAA P10253 6/20 0.43
HPGD P15428 5/20 0.43
GLA P06280 4/20 0.43
ABCC9 O60706 6/20 0.42
ABCC8 Q09428 6/20 0.42
KCNJ11 Q14654 6/20 0.42
KCNJ8 Q15842 6/20 0.42
VCAM1 P19320 1/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KMT2A Q03164 2/20 0.39
CASP1 P29466 1/20 0.38
CASP7 P55210 1/20 0.38
HSD17B10 Q99714 1/20 0.38
PKM P14618 1/20 0.38
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7102992 0.87 KDM4E (0.48) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL7011365 0.82 ALDH1A1 (0.48) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL7101772 0.82 ABCC9 (0.49) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL7100408 0.82 KDM4E (0.44) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL7099480 0.79 ABCC9 (0.52) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL7583051 0.79 ABCC9 (0.52) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL5078130 0.77 ABCC9 (0.61) ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL7098825 0.76 ABCC9 (0.66) ALDH1A1KDM4EABCC9ABCC8KCNJ11
SCHEMBL7101783 0.74 ABCC9 (0.48) ALDH1A1KDM4EGAAHPGDGLA
SCHEMBL7575205 0.71 ABCC9 (0.42) ALDH1A1KDM4EGAAHPGDGLA

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-20020099070-A1 Dihydronaphthyridine potassium channel openers ABBOTT LABORATORIES 2002-07-25 US claimed
US-20020099070-A1 Dihydronaphthyridine potassium channel openers ABBOTT LABORATORIES 2002-07-25 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-20020099070-A1 Dihydronaphthyridine potassium channel openers KCNH1, KCNN1, KCNJ2 ALDH1A1 555/4885KDM4E 1292/4885GAA 1909/4885

“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.