SCHEMBL6537366

SCHEMBL6537366

CC=C(C)Cn1c(C)cnc1[N+](=O)[O-]

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.44
LMNA P02545 3/20 0.40
MAPK1 P28482 2/20 0.37
ALDH1A1 P00352 1/20 0.37
THRB P10828 1/20 0.37
TSHR P16473 1/20 0.37
ATM Q13315 1/20 0.35
MITF O75030 1/20 0.35
EGFR P00533 5/20 0.33
ERBB2 P04626 5/20 0.33
CHRM1 P11229 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GLA P06280 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32

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
SCHEMBL6131590 0.79 SMN1; SMN2 (0.44) SMN1; SMN2LMNAMAPK1ALDH1A1THRB
SCHEMBL11777752 0.77 SMN1; SMN2 (0.46) SMN1; SMN2LMNAMAPK1ALDH1A1THRB
SCHEMBL24270457 0.76 LMNA (0.58) SMN1; SMN2LMNAMAPK1ALDH1A1THRB
SCHEMBL12391228 0.74 SMN1; SMN2 (0.50) SMN1; SMN2LMNAMAPK1ALDH1A1THRB
SCHEMBL15177274 0.72 LMNA (0.46) SMN1; SMN2LMNAMAPK1ALDH1A1THRB
Bromide SCHEMBL17079938 0.72 SMN1; SMN2 (0.48) SMN1; SMN2LMNAMAPK1ALDH1A1THRB
SCHEMBL6131601 0.71 SMN1; SMN2 (0.41) SMN1; SMN2LMNAALDH1A1THRBMITF
SCHEMBL18633377 0.71 CHRM1 (0.63) SMN1; SMN2LMNAMAPK1ALDH1A1THRB
SCHEMBL17198863 0.68 SMN1; SMN2 (0.47) SMN1; SMN2LMNAMAPK1ALDH1A1THRB
SCHEMBL4962139 0.68 ENO1 (0.40) SMN1; SMN2LMNAMAPK1ALDH1A1THRB

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-20040010127-A1 RHENIUM AND TECHNETIUM COMPLEXES CONTAINING A HYPOXIA-LOCALIZING MOIETY BRACCO SUISSE SA (CH) 2004-01-15 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-20040010127-A1 RHENIUM AND TECHNETIUM COMPLEXES CONTAINING A HYPOXIA-LOCALIZING MOIETY HIF1A, HIF1AN, SLC2A8 SMN1; SMN2 3718/4885LMNA 4114/4885MAPK1 3468/4885

“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.