Iodomethane

Iodomethane

SCHEMBL1225554

CI.Cc1cc(C=Cc2ccc([N+](=O)[O-])cc2)c2ccccc2n1

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 9/20 0.55
POLB P06746 1/20 0.55
NQO2 P16083 1/20 0.54
NPC1 O15118 2/20 0.53
MAPT P10636 8/20 0.50
SMN1; SMN2 Q16637 6/20 0.50
HTT P42858 4/20 0.50
KDM4E B2RXH2 2/20 0.50
MAPK1 P28482 1/20 0.50
RAB9A P51151 1/20 0.50
SLC2A1 P11166 1/20 0.48
MEN1 O00255 7/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 1/20 0.47
LMNA P02545 3/20 0.46
GAA P10253 1/20 0.46
JAK2 O60674 1/20 0.46
MITF O75030 1/20 0.46
PAX8 Q06710 1/20 0.46
TDP1 Q9NUW8 1/20 0.45

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
SCHEMBL1225258 0.97 KMT2A (0.57) KMT2APOLBNQO2NPC1MAPT
Bromide SCHEMBL6113767 0.96 KMT2A (0.56) KMT2APOLBNQO2NPC1MAPT
SCHEMBL1226543 0.78 NQO2 (0.59) KMT2ANQO2NPC1MAPTSMN1; SMN2
SCHEMBL8559988 0.76 NFE2L2 (0.47) KMT2APOLBNQO2NPC1MAPT
SCHEMBL5271563 0.76 MAPT (0.59) KMT2ANQO2NPC1MAPTSMN1; SMN2
SCHEMBL5276926 0.76 MAPT (0.59) KMT2ANQO2NPC1MAPTSMN1; SMN2
SCHEMBL1226503 0.76 MAPT (0.63) KMT2ANQO2NPC1MAPTSMN1; SMN2
SCHEMBL1225549 0.74 KMT2A (0.62) KMT2APOLBNPC1MAPTSMN1; SMN2
SCHEMBL7468007 0.72 KMT2A (0.60) KMT2APOLBNPC1MAPTSMN1; SMN2
SCHEMBL10940074 0.72 CYP19A1 (0.62) NPC1MAPTSMN1; SMN2HTTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2459737-B1 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES BIOMERIEUX SA (FR) 2014-10-29 EP claimed
US-8592175-B2 Nitroreductase enzymatic substrates bioMérieux, S.A. (FR) 2013-11-26 US claimed
EP-2459737-A2 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES Biomérieux (FR) 2012-06-06 EP claimed
US-20120129204-A1 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES bioMerieux, SA (FR) 2012-05-24 US claimed
WO-2011012824-A2 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES bioMérieux (FR) 2011-02-03 WO claimed
EP-2459737-B1 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES BIOMERIEUX SA (FR) 2014-10-29 EP disclosed
US-8592175-B2 Nitroreductase enzymatic substrates bioMérieux, S.A. (FR) 2013-11-26 US disclosed
EP-2459737-A2 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES Biomérieux (FR) 2012-06-06 EP disclosed
US-20120129204-A1 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES bioMerieux, SA (FR) 2012-05-24 US disclosed
WO-2011012824-A2 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES bioMérieux (FR) 2011-02-03 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-20120129204-A1 NOVEL NITROREDUCTASE ENZYMATIC SUBSTRATES CBR1, CBR3, POR KMT2A 3575/4885POLB 2150/4885NQO2 158/4885

“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.