Methane

Methane

SCHEMBL6327614

C.CCOC(=O)Cc1ccc(C(=O)CCCN2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1

nearest known ligand 0.75

Full drug profile on Sugi Atlas →

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ CYP2J2 P51589 13/20 0.75
▸ CYP3A4 P08684 2/20 0.73
▸ CYP2C9 P11712 2/20 0.73
▸ CYP2B6 P20813 2/20 0.73
▸ HRH1 P35367 5/20 0.57
▸ KCNH2 Q12809 2/20 0.56

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
Methane SCHEMBL6325016 0.86 CYP2J2 (0.77) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
SCHEMBL11793534 0.86 CYP2J2 (1.00) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
Hydrochloric Acid SCHEMBL11795603 0.85 CYP2J2 (0.98) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
SCHEMBL27627976 0.85 CYP2J2 (0.74) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
Methane SCHEMBL6332223 0.84 HRH1 (0.66) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
SCHEMBL48803 0.84 CYP2J2 (0.75) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
SCHEMBL12139245 0.84 CYP2J2 (1.00) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
Hydrochloric Acid SCHEMBL2235075 0.83 CYP2J2 (0.74) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
Hydrochloric Acid SCHEMBL11791455 0.83 CYP2J2 (0.98) CYP2J2CYP3A4CYP2C9CYP2B6HRH1
SCHEMBL11798280 0.83 CYP2J2 (0.84) CYP2J2CYP3A4CYP2C9CYP2B6HRH1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050239834-A1 Novel 4-diphenylmethyl piperidine derivatives AVENTIS PHARMACEUTICALS INC. (US) 2005-10-27 — — US disclosed
US-20040167169-A1 Novel 4-diphenylmethyl piperidine derivatives AVENTIS PHARMACEUTICALS INC. 2004-08-26 — — US disclosed
US-20030065186-A1 Novel 4-diphenylethyl piperidine derivatives LING KAH HIING (US) 2003-04-03 — — US disclosed
US-20020016467-A1 Novel 4-diphenylmethyl piperdine derivatives LING KAH HIING (US) 2002-02-07 — — 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-20040167169-A1 Novel 4-diphenylmethyl piperidine derivatives HRH4, HRH2, HRH1 CYP2J2 277/4885CYP3A4 161/4885CYP2C9 1238/4885
US-20020016467-A1 Novel 4-diphenylmethyl piperdine derivatives HRH4, HRH2, HRH1 CYP2J2 252/4885CYP3A4 149/4885CYP2C9 426/4885
US-20050239834-A1 Novel 4-diphenylmethyl piperidine derivatives HRH4, HRH2, HRH1 CYP2J2 277/4885CYP3A4 161/4885CYP2C9 1238/4885
US-20030065186-A1 Novel 4-diphenylethyl piperidine derivatives HRH4, HRH2, HRH1 CYP2J2 258/4885CYP3A4 140/4885CYP2C9 1298/4885

“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.

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