Iodomethane

Iodomethane

SCHEMBL3386568

CI.OCCN1CCCC1

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

PTGS1PTGS2

The experimentally established mechanism targets of Iodomethane. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.47
MEN1 O00255 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 1/20 0.46
CARM1 Q86X55 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
PRMT8 Q9NR22 1/20 0.44
HRH3 Q9Y5N1 2/20 0.43
LMNA P02545 2/20 0.43
HTT P42858 1/20 0.43
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.39
CYP1A2 P05177 1/20 0.38
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PKM P14618 1/20 0.37

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
SCHEMBL8387 0.91
SCHEMBL9020695 0.91
SCHEMBL29025500 0.91 ALDH1A1 (0.52) KMT2AMEN1CYP3A4CYP2C9CYP2C19
Methylamine SCHEMBL18497691 0.89 KMT2A (0.47) KMT2AMEN1CYP3A4CYP2C9CYP2C19
SCHEMBL14856230 0.88 KMT2A (0.56) KMT2AMEN1CYP3A4CYP2C9CYP2C19
SCHEMBL19172427 0.88 KMT2A (0.56) KMT2AMEN1CYP3A4CYP2C9CYP2C19
SCHEMBL227313 0.88 KMT2A (0.56) KMT2AMEN1CYP3A4CYP2C9CYP2C19
SCHEMBL7757481 0.88 KMT2A (0.56) KMT2AMEN1CYP3A4CYP2C9CYP2C19
Potassium SCHEMBL31451607 0.88
Iodide SCHEMBL28520795 0.88 KMT2A (0.50) KMT2AMEN1CYP3A4CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150297576-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CANCER TRASLATIONAL CANCER DRUGS PHARMA S L (ES) 2015-10-22 US disclosed
US-20150098927-A1 METHODS FOR TREATMENT AND DIAGNOSIS OF CANCER TRASLATIONAL CANCER DRUGS PHARMA, S.L. (ES) 2015-04-09 US disclosed
US-20150004252-A1 METHOD FOR PREDICTING THE CLINICAL RESPONSE TO CHEMOTHERAPY IN A SUBJECT WITH CANCER TRASLATIONAL CANCER DRUGS PHARMA, S.L (ES) 2015-01-01 US disclosed
EP-2721174-A1 METHOD FOR PREDICTING THE CLINICAL RESPONSE TO CHEMOTHERAPY IN A SUBJECT WITH CANCER Traslational Cancer Drugs Pharma, S.L. (ES) 2014-04-23 EP disclosed
WO-2012175537-A1 METHOD FOR PREDICTING THE CLINICAL RESPONSE TO CHEMOTHERAPY IN A SUBJECT WITH CANCER TRASLATIONAL CANCER DRUGS PHARMA, S.L. (ES) 2012-12-27 WO disclosed
US-20100068302-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CANCER TRASLATIONAL CANCER DRUGS PHARMA, S.L. (ES) 2010-03-18 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 (4 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-20150297576-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CANCER ASAH1, ACER2, ASAH2 KMT2A 929/4885MEN1 2480/4885CYP3A4 4154/4885
US-20150098927-A1 METHODS FOR TREATMENT AND DIAGNOSIS OF CANCER CHKA, CHKB, CEPT1 KMT2A 356/4885MEN1 2001/4885CYP3A4 3749/4885
US-20100068302-A1 METHODS AND COMPOSITIONS FOR THE TREATMENT OF CANCER ASAH1, ACER2, ASAH2 KMT2A 929/4885MEN1 2480/4885CYP3A4 4154/4885
US-20150004252-A1 METHOD FOR PREDICTING THE CLINICAL RESPONSE TO CHEMOTHERAPY IN A SUBJECT WITH CANCER CHKA, CHKB, DCK KMT2A 1330/4885MEN1 3315/4885CYP3A4 2576/4885

“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.