SCHEMBL4300592

SCHEMBL4300592

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
POLB P06746 2/20 0.37
ALOX5 P09917 1/20 0.34
LCK P06239 3/20 0.33
TDP1 Q9NUW8 2/20 0.33
SMN1; SMN2 Q16637 3/20 0.32
PRMT1 Q99873 1/20 0.32
ATR Q13535 1/20 0.32
MAPT P10636 5/20 0.31
ALDH1A1 P00352 2/20 0.31
KDM4E B2RXH2 1/20 0.31
CASP3 P42574 1/20 0.31
RECQL P46063 1/20 0.31
MCL1 Q07820 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31

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
SCHEMBL4723179 0.83 POLB (0.41) GAAKMT2AMEN1NPC1RAB9A
SCHEMBL13663007 0.82 KMT2A (0.39) GAAKMT2AMEN1NPC1RAB9A
SCHEMBL5027847 0.81 LATS1 (0.37) POLBLCKSMN1; SMN2PRMT1ATR
SCHEMBL1490695 0.80 STK17B (0.44) GAAKMT2AMEN1POLBTDP1
SCHEMBL6097448 0.80 STK17B (0.47) GAAKMT2AMEN1POLBTDP1
SCHEMBL4299824 0.80 GAA (0.45) GAAKMT2AMEN1NPC1RAB9A
SCHEMBL14594180 0.78 GAA (0.67) GAAKMT2AMEN1NPC1RAB9A
SCHEMBL5334549 0.78 POLB (0.39) POLBTDP1
SCHEMBL5027849 0.78 POLB (0.35) POLBSMN1; SMN2
SCHEMBL12776916 0.77 POLB (0.38) POLBKDM4E

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 3 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
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 GAA 2007/4885KMT2A 3187/4885MEN1 2721/4885

“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.