SCHEMBL4300514

SCHEMBL4300514

Cc1nc(Cl)c([N+](=O)[O-])c(NN(C)C)c1C

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
MAPT P10636 1/20 0.36
MAPK1 P28482 3/20 0.32
SMN1; SMN2 Q16637 2/20 0.31
TDP1 Q9NUW8 1/20 0.30
ALDH1A1 P00352 1/20 0.30
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 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
SCHEMBL13527456 0.77 POLB (0.42) POLBMAPTMAPK1SMN1; SMN2TDP1
SCHEMBL4772531 0.76 POLB (0.41) POLBMAPTMAPK1SMN1; SMN2TDP1
SCHEMBL4776148 0.76 POLB (0.44) POLBMAPTSMN1; SMN2CYP1A2CYP3A4
SCHEMBL4723179 0.76 POLB (0.41) POLBMAPTMAPK1SMN1; SMN2TDP1
SCHEMBL13939169 0.76 POLB (0.41) POLBMAPTMAPK1SMN1; SMN2TDP1
SCHEMBL3172845 0.76 POLB (0.42) POLBMAPTSMN1; SMN2TDP1ALDH1A1
SCHEMBL2059190 0.75 POLB (0.46) POLBMAPTMAPK1SMN1; SMN2TDP1
SCHEMBL4776141 0.75 POLB (0.43) POLBMAPTSMN1; SMN2TDP1ALDH1A1
SCHEMBL563117 0.75 POLB (0.38) POLBMAPTMAPK1TDP1ALDH1A1
SCHEMBL5027849 0.75 POLB (0.35) POLBMAPK1SMN1; SMN2

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-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. 2009-10-29 US disclosed
WO-2006026760-A2 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-09 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-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS IL2, IL4I1, IFNG POLB 1638/4885MAPT 3772/4885MAPK1 1778/4885

“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.