Methane

Methane

SCHEMBL2343754

C.O=C(O)NC(c1ccc2c(c1)OCO2)[N+](=O)[O-]

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.47
MEN1 O00255 2/20 0.47
RAB9A P51151 1/20 0.47
GAA P10253 1/20 0.46
MAPT P10636 1/20 0.46
ALDH1A1 P00352 3/20 0.44
HPGD P15428 1/20 0.44
MAPK9 P45984 1/20 0.43
POLB P06746 1/20 0.43
MME P08473 1/20 0.43
MAPK1 P28482 1/20 0.42
EDNRA P25101 2/20 0.42
PTGS1 P23219 1/20 0.40
PTGS2 P35354 1/20 0.40

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
SCHEMBL9392816 0.75 RAB9A (0.46) KMT2AMEN1RAB9AGAAMAPT
SCHEMBL8874113 0.75 MAPK9 (0.48) KMT2AMEN1RAB9AGAAMAPT
SCHEMBL9788832 0.73 CYP1A2 (0.49) RAB9AALDH1A1HPGDMAPK1EDNRA
SCHEMBL29213144 0.72 CYP1A2 (0.48) KMT2AMEN1RAB9AGAAMAPT
SCHEMBL1428266 0.72 GAA (0.49) KMT2AMEN1RAB9AGAAMAPT
Methane SCHEMBL28340880 0.72 MAPT (0.42) KMT2AMEN1RAB9AGAAMAPT
Methane SCHEMBL2042661 0.72 MAPT (0.43) KMT2AMEN1RAB9AGAAMAPT
SCHEMBL2298417 0.71 GAA (0.46) KMT2AMEN1RAB9AGAAMAPT
SCHEMBL2029476 0.71 MAPT (0.41) KMT2AMEN1MAPTALDH1A1POLB
SCHEMBL1695045 0.70 GAA (0.48) KMT2AMEN1RAB9AGAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118139851-A Antitumor compounds 法马马有限公司 2024-06-04 CN disclosed
EP-3898613-B1 ANTICANCER COMPOUNDS PHARMA MAR SA (ES) 2023-08-09 EP disclosed
US-20220056021-A1 ANTICANCER COMPOUNDS PHARMA MAR, S.A. (ES) 2022-02-24 US disclosed
EP-2576569-B1 SYNTHETIC PROCESS FOR THE MANUFACTURE OF ECTEINASCIDIN COMPOUNDS AND INTERMEDIATES PHARMA MAR SA (ES) 2015-01-14 EP disclosed
EP-2792683-A1 Compounds potentiating the activity of antifungal drugs Fundacion MEDINA. Centro de Excelencia en Investigacion de Medicamentos Innovadores en Andalucia (ES) 2014-10-22 EP disclosed
US-8748388-B2 Antitumoral compounds PHARMA MAR, S.A. (ES) 2014-06-10 US disclosed
EP-2231695-B1 ANTITUMORAL COMPOUNDS PHARMA MAR SA (ES) 2013-02-13 EP disclosed
US-20110207674-A2 ANTITUMORAL COMPOUNDS PHARMA MAR, S.A. (ES) 2011-08-25 US disclosed
US-20100292163-A1 Antitumoral Compounds PHARMA MAR, S.A. (ES) 2010-11-18 US disclosed
EP-2231695-A1 ANTITUMORAL COMPOUNDS Pharma Mar S.A. (ES) 2010-09-29 EP disclosed
WO-2009077401-A1 ANTITUMORAL COMPOUNDS PHARMA MAR, S.A. (ES) 2009-06-25 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 (3 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-20110207674-A2 ANTITUMORAL COMPOUNDS TP53, XPO1, TOP2B KMT2A 4262/4885MEN1 171/4885RAB9A 1796/4885
US-20100292163-A1 Antitumoral Compounds TP53, XPO1, TOP2B KMT2A 4262/4885MEN1 171/4885RAB9A 1796/4885
US-20220056021-A1 ANTICANCER COMPOUNDS TP53, MCL1, MYC KMT2A 3314/4885MEN1 1162/4885RAB9A 873/4885

“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.