SCHEMBL4307213

SCHEMBL4307213

Cc1c(Cl)nc(N(Cc2ccccc2)Cc2ccccc2)c([N+](=O)[O-])c1NNC(=O)OC(C)(C)C

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.43
MEN1 O00255 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KMT2A Q03164 1/20 0.43
AKT1 P31749 3/20 0.38
P2RX7 Q99572 2/20 0.36
LMNA P02545 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CTSL P07711 2/20 0.35
CTSB P07858 2/20 0.35
CTSS P25774 2/20 0.35
ALOX5 P09917 1/20 0.35
NR1D1 P20393 1/20 0.34
NR1H3 Q13133 1/20 0.34
CYP2C9 P11712 1/20 0.34
PTGER1 P34995 1/20 0.34
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL4301033 0.91 KMT2A (0.45) GAAMEN1NPC1RAB9AKMT2A
SCHEMBL6094679 0.85 BRD4 (0.40) MEN1KMT2A
SCHEMBL4299371 0.85 GAA (0.47) GAAMEN1NPC1RAB9AKMT2A
SCHEMBL4296286 0.81 KMT2A (0.40) GAAMEN1NPC1RAB9AKMT2A
SCHEMBL4299689 0.80 RAB9A (0.42) GAAMEN1NPC1RAB9AKMT2A
SCHEMBL5793537 0.78 KMT2A (0.40) GAARAB9AKMT2AP2RX7LMNA
SCHEMBL5793540 0.78 KMT2A (0.40) GAARAB9AKMT2AP2RX7LMNA
SCHEMBL6688243 0.76 LMNA (0.35) MEN1RAB9AKMT2ALMNASMN1; SMN2
SCHEMBL6096675 0.76 BRD4 (0.41) MEN1KMT2A
SCHEMBL6688230 0.76 LMNA (0.35) MEN1RAB9AKMT2ALMNASMN1; 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 GAA 2007/4885MEN1 2721/4885NPC1 3339/4885

“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.