SCHEMBL4052792

SCHEMBL4052792

Fc1ccccc1-c1nc2c([nH]1)C=NN(Cc1ccc(Cl)nc1)C2

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 1/20 0.37
KMT2A Q03164 3/20 0.36
CXCR2 P25025 1/20 0.35
GAA P10253 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
GRM2 Q14416 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
SCHEMBL4051004 0.92 GRIN2B (0.34) ACP1KMT2AGAAMAPTGRM2
SCHEMBL4052721 0.90 ACP1 (0.38) ACP1KMT2ACXCR2GAAMEN1
SCHEMBL3187809 0.89 CXCR2 (0.38) ACP1KMT2ACXCR2GAAMEN1
SCHEMBL4051886 0.83 ALDH1A1 (0.33) ACP1KMT2ACXCR2GAAMEN1
SCHEMBL4057704 0.82 GRIN2B (0.35) ACP1
SCHEMBL3210128 0.81 BCHE (0.35) KMT2ACXCR2MEN1HPGDSMN1; SMN2
SCHEMBL4050642 0.80 GRIN2B (0.34) CYP11B1GRM2
SCHEMBL4058137 0.79 GRIN2B (0.36) ACP1KMT2ACXCR2MEN1HPGD
SCHEMBL4061304 0.78 KCNH2 (0.40) CYP11B1CYP11B2GRM2
SCHEMBL4048779 0.78 GRIN2B (0.36) ACP1

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
WO-2009111501-A1 DERIVATIVES OF IMIDAZO [4, 5-D] PYRIDAZINE AND THEIR USE AS ANTI-VIRAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-09-11 WO disclosed
US-20090226398-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE GENELABS TECHNOLOGIES, INC. 2009-09-10 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-20090226398-A1 ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE MAVS, SARS1, HAVCR2 ACP1 3723/4885KMT2A 4655/4885CXCR2 1858/4885

“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.