Methane

Methane

SCHEMBL14738986

C.c1cnc2[nH]ccc2c1

nearest known ligand 0.95

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AXL P30530 4/20 0.95
NUDT1 P36639 3/20 0.95
MAPK1 P28482 2/20 0.46
CDK8 P49336 2/20 0.44
PIK3CD O00329 1/20 0.43
PIK3CA P42336 1/20 0.43
PIK3CB P42338 1/20 0.43
PIK3CG P48736 1/20 0.43
PRKCI P41743 3/20 0.42
KDM4E B2RXH2 1/20 0.41
GMNN O75496 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
HSP90AA1 P07900 1/20 0.41
MMP2 P08253 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
MMP9 P14780 1/20 0.41
ALOX15 P16050 1/20 0.41

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
SCHEMBL709685 0.98 AXL (1.00) AXLNUDT1MAPK1CDK8PIK3CD
SCHEMBL29523425 0.98
SCHEMBL17837 0.98
SCHEMBL27692181 0.95
SCHEMBL27753650 0.95 AXL (0.95) AXLNUDT1MAPK1CDK8PIK3CD
Bromide SCHEMBL27394282 0.95 AXL (0.95) AXLNUDT1MAPK1CDK8PIK3CD
Hydrochloric Acid SCHEMBL27893779 0.95 AXL (0.95) AXLNUDT1MAPK1CDK8PIK3CD
Ammonia Solution, Strong SCHEMBL27486357 0.95 AXL (0.95) AXLNUDT1MAPK1CDK8PIK3CD
Potassium SCHEMBL30760557 0.95 AXL (0.95) AXLNUDT1MAPK1CDK8PIK3CD
Hydrochloric Acid SCHEMBL5325493 0.95 AXL (0.95) AXLNUDT1MAPK1CDK8PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130059850-A1 AZA-INDOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH MERCK SHARP & DOHME CORP. (US) 2013-03-07 US claimed

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-20130059850-A1 AZA-INDOLE DERIVATIVES USEFUL AS MODULATORS OF FAAH FAAH, FAAH2, IDO1 AXL 4355/4885NUDT1 2012/4885MAPK1 3902/4885

“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.