Methane

Methane

SCHEMBL3600692

C.NC1CCN(CCc2ccc(F)cc2)CC1

nearest known ligand 0.66

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SPHK1 Q9NYA1 1/20 0.61
HTR2A P28223 4/20 0.58
HTR2C P28335 3/20 0.58
HTR7 P34969 3/20 0.58
HTR6 P50406 2/20 0.58
MAOA P21397 1/20 0.51
KCNJ1 P48048 1/20 0.51
KCNH2 Q12809 1/20 0.51
HRH3 Q9Y5N1 1/20 0.50

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
SCHEMBL3599810 0.98 SPHK1 (0.63) SPHK1HTR2AHTR2CHTR7HTR6
SCHEMBL3596842 0.89 SPHK1 (0.60) SPHK1HTR2AHTR2CHTR7HTR6
SCHEMBL3601901 0.89 HTR2A (0.54) SPHK1HTR2AHTR2CHTR7HTR6
SCHEMBL7723203 0.89 HTR2A (0.54) SPHK1HTR2AHTR2CHTR7HTR6
SCHEMBL7228646 0.82 SPHK1 (0.50) SPHK1HTR2AHTR2CHTR7HTR6
SCHEMBL3600688 0.82 HTR2A (0.57) HTR2AHTR2CHTR7HTR6KCNH2
SCHEMBL1457116 0.81 HTR2A (0.64) SPHK1HTR2AHTR2CHTR7HTR6
SCHEMBL14708456 0.81 HRH3 (0.75) HTR2AHTR2CHTR7HTR6KCNH2
SCHEMBL4079382 0.81 HTR2A (0.60) HTR2AHTR2CHTR7HTR6MAOA
SCHEMBL13556830 0.81 SPHK1 (0.63) SPHK1HTR2AHTR2CHTR7HTR6

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
US-8507528-B2 2-alkyl-indazole compounds for the treatment of certain cns-related disorders AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2013-08-13 US disclosed
EP-2099780-B1 2 -ALKYL- INDAZOLE COMPOUNDS FOR THE TREATMENT OF CERTAIN CNS-RELATED DISORDERS ACRAF (IT) 2013-01-09 EP disclosed
US-20100056573-A1 2-ALKYL-INDAZOLE COMPOUNDS FOR THE TREATMENT OF CERTAIN CNS-RELATED DISORDERS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2010-03-04 US disclosed
EP-2099780-A1 2 -ALKYL- INDAZOLE COMPOUNDS FOR THE TREATMENT OF CERTAIN CNS-RELATED DISORDERS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.p.A. (IT) 2009-09-16 EP disclosed
WO-2008061688-A1 2 -ALKYL- INDAZOLE COMPOUNDS FOR THE TREATMENT OF CERTAIN CNS-RELATED DISORDERS AZIENDE CHIMICHE RIUNITE ANGELINI FRANCESCO A.C.R.A.F. S.P.A. (IT) 2008-05-29 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-20100056573-A1 2-ALKYL-INDAZOLE COMPOUNDS FOR THE TREATMENT OF CERTAIN CNS-RELATED DISORDERS CYP11B2, CYP1A2, INA SPHK1 4111/4885HTR2A 263/4885HTR2C 173/4885

“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.