Methane

Methane

SCHEMBL2772452

C.N#CCN1CCOCC1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.43
KDM4E B2RXH2 3/20 0.43
HSD17B10 Q99714 3/20 0.41
RECQL P46063 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
USP2 O75604 1/20 0.39
KEAP1 Q14145 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ALOX15 P16050 1/20 0.35
TSHR P16473 1/20 0.35
GLA P06280 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34

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
SCHEMBL64383 0.97
SCHEMBL1306972 0.91 ALDH1A1 (0.56) ALDH1A1KDM4EHSD17B10RECQLPOLB
SCHEMBL2249699 0.89 ALDH1A1 (0.41) ALDH1A1KDM4EHSD17B10RECQLPOLB
Propionic Acid SCHEMBL3861692 0.80 HSD17B10 (0.53) ALDH1A1KDM4EHSD17B10RECQLSMN1; SMN2
SCHEMBL2576487 0.78 ALDH1A1 (0.50) ALDH1A1POLBSMN1; SMN2
SCHEMBL11701515 0.78
SCHEMBL7137154 0.78 ALDH1A1 (0.50) ALDH1A1POLBSMN1; SMN2
SCHEMBL1308786 0.78 ALDH1A1 (0.40) ALDH1A1KDM4ESMN1; SMN2HRH3
SCHEMBL11501758 0.76 ALDH1A1 (0.57) ALDH1A1KDM4EPOLBGAASMN1; SMN2
SCHEMBL6929250 0.76 POLB (0.59) ALDH1A1KDM4EHSD17B10RECQLPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1581532-B1 PYRAZOLO¬3,4-B PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2010-04-28 EP disclosed
US-7528148-B2 Pyrazolo[3,4-B]pyridine compounds, and their use as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2009-05-05 US disclosed
US-20060252790-A1 Pyrazolo [3,4-b] pyridine compounds, and their use as phosphodiesterase inhibitors GLAXO GROUP LIMITED (GB) 2006-11-09 US disclosed
EP-1581532-A1 PYRAZOLO[3,4-B]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-10-05 EP disclosed
WO-2004056823-A1 PYRAZOLO[3,4-b]PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2004-07-08 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-20060252790-A1 Pyrazolo [3,4-b] pyridine compounds, and their use as phosphodiesterase inhibitors PDE4A, PDE4B, PDE3B ALDH1A1 1315/4885KDM4E 1086/4885HSD17B10 668/4885

“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.