SCHEMBL14068446

SCHEMBL14068446

[N-]=[N+]=NCc1cc(F)ccn1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ PPARG P37231 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.30

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
SCHEMBL28109270 0.82 SREBF2 (0.39) KDM4EALDH1A1HTR2CSLC6A4ABCG2
SCHEMBL15409505 0.81 KDM4E (0.41) KDM4EALDH1A1HTR2CSLC6A4
SCHEMBL17123710 0.79 UHRF1 (0.41) KDM4EALDH1A1HTR2CSLC6A4
SCHEMBL27592196 0.79 KDM4E (0.42) KDM4EALDH1A1
SCHEMBL15284970 0.79 ALDH1A1 (0.39) KDM4EALDH1A1HTR2CSLC6A4
SCHEMBL17832058 0.77 NOS3 (0.46) KDM4EALDH1A1HTR2CSLC6A4
SCHEMBL14948663 0.75 KDM4E (0.37) KDM4EALDH1A1HTR2CSLC6A4
SCHEMBL15285044 0.75 NOS2 (0.53) KDM4EALDH1A1
SCHEMBL21711927 0.73 KDM4C (0.46) KDM4EALDH1A1
SCHEMBL14945524 0.73 KDM4E (0.35) KDM4EALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7928210-B2 Nucleoside based proliferation imaging markers SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2011-04-19 — — US disclosed
US-20090016958-A1 Nucleoside based proliferation imaging markers SIEMENS MEDICAL SOLUTIONS USA, INC. 2009-01-15 — — US disclosed
WO-2008109080-A2 NUCLEOSIDE BASED PROLIFERATION IMAGING MARKERS SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2008-09-12 — — WO disclosed
WO-2008109080-A2 NUCLEOSIDE BASED PROLIFERATION IMAGING MARKERS SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2008-09-12 — — 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-20090016958-A1 Nucleoside based proliferation imaging markers MKI67, SLC29A1, SLC29A2 KDM4E 4684/4885ALDH1A1 2624/4885HTR2C 3889/4885

“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.

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