Methane

Methane

SCHEMBL3496356

C.Cc1c(O)ccc2ccccc12

nearest known ligand 0.58

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 3/20 0.58
▸ TSHR P16473 3/20 0.58
▸ CYP2A6 P11509 2/20 0.58
▸ PTPN22 Q9Y2R2 1/20 0.58
▸ POLB P06746 1/20 0.54
▸ HSD17B10 Q99714 3/20 0.52
▸ USP2 O75604 1/20 0.52
▸ PAK1 Q13153 1/20 0.52
▸ CYP2C9 P11712 1/20 0.52
▸ CYP2C19 P33261 1/20 0.52
▸ KDM4E B2RXH2 4/20 0.48
▸ MAPT P10636 4/20 0.48
▸ TDP1 Q9NUW8 2/20 0.48
▸ ESR1 P03372 1/20 0.48
▸ ESR2 Q92731 1/20 0.48
▸ ALDH1A1 P00352 3/20 0.48
▸ GAA P10253 3/20 0.48
▸ TAAR1 Q96RJ0 1/20 0.48
▸ ERN1 O75460 1/20 0.48
▸ HPGD P15428 2/20 0.47

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
SCHEMBL254544 0.98 CYP1A2 (0.60) CYP1A2TSHRCYP2A6PTPN22POLB
SCHEMBL29946590 0.98 CYP1A2 (0.60) CYP1A2TSHRCYP2A6PTPN22POLB
Betanaphthol SCHEMBL17506723 0.85 CYP1A2 (0.61) CYP1A2TSHRCYP2A6PTPN22POLB
SCHEMBL27725822 0.79 HPRT1 (0.54) CYP1A2TSHRCYP2A6PTPN22POLB
SCHEMBL3835260 0.78 ESR1 (0.50) CYP1A2CYP2A6PTPN22POLBHSD17B10
1-Naphthol SCHEMBL28077896 0.77 CYP1A2 (0.77) CYP1A2TSHRCYP2A6PTPN22POLB
Methane SCHEMBL16097895 0.76 CYP2A6 (0.95) CYP1A2TSHRCYP2A6HSD17B10MAPT
Methane SCHEMBL27863330 0.76 PTPN22 (0.95) CYP1A2TSHRCYP2A6PTPN22POLB
Methane SCHEMBL10406101 0.76 PTPN22 (0.62) CYP1A2TSHRCYP2A6PTPN22POLB
Methane SCHEMBL7103973 0.76 PTPN22 (0.95) CYP1A2TSHRCYP2A6PTPN22POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8236819-B2 Dihydro-[1H]-quinolin-2-one derivatives as RXR agonists for the treatment of dyslipidemia, hypercholesterolemia and diabetes JANSSEN PHARMACEUTICA N.V. (BE) 2012-08-07 — — US disclosed
US-20100105728-A1 DIHYDRO-[1H]-QUINOLIN-2-ONE DERIVATIVES AS RXR AGONISTS FOR THE TREATMENT OF DYSLIPIDEMIA, HYPERCHOLESTEROLEMIA AND DIABETES LAGU BHARAT 2010-04-29 — — US disclosed
US-7638533-B2 3-[3-(1-Ethyl-4,4,6-trimethyl-2-oxo- 1,2,3,4-tetrahydro-quinolin-7-yl)-4- (2,2,2-trifluoro-ethoxy)-phenyl]- acrylic acid;Retinoid X Receptor (RXR) agonists useful for treating the onset of cancer and metabolic disorders such as diabetes, dyslipidemia, and hypercholesterolemia JANSSEN PHARMACEUTICA N.V. (BE) 2009-12-29 — — US disclosed
EP-1937641-A2 DIHYDRO-[1H]-QUINOLIN-2-ONE DERIVATIVES AS RXR AGONISTS FOR THE TREATMENT OF DYSLIPIDEMIA, HYPERCHOLESTEROLEMIA AND DIABETES Janssen Pharmaceutica, N.V. (BE) 2008-07-02 — — EP disclosed
WO-2007041112-A2 DIHYDRO-[1H]-QUINOLIN-2-ONE DERIVATIVES AS RXR AGONISTS FOR THE TREATMENT OF DYSLIPIDEMIA, HYPERCHOLESTEROLEMIA AND DIABETES JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-12 — — WO disclosed
US-20070078160-A1 DIHYDRO-[1H]-QUINOLIN-2-ONE DERIVATIVES AS RXR AGONISTS FOR THE TREATMENT OF DYSLIPIDEMIA, HYPERCHOLESTEROLEMIA AND DIABETES JANSSEN PHARMACEUTICA N.V. (BE) 2007-04-05 — — US disclosed
EP-0393941-A1 Naphthalene derivatives AMERICAN HOME PRODUCTS CORPORATION (US) 1990-10-24 — — EP 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 (2 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-20070078160-A1 DIHYDRO-[1H]-QUINOLIN-2-ONE DERIVATIVES AS RXR AGONISTS FOR THE TREATMENT OF DYSLIPIDEMIA, HYPERCHOLESTEROLEMIA AND DIABETES NR1H2, RXRA, NR1H3 CYP1A2 187/4885TSHR 385/4885CYP2A6 234/4885
US-20100105728-A1 DIHYDRO-[1H]-QUINOLIN-2-ONE DERIVATIVES AS RXR AGONISTS FOR THE TREATMENT OF DYSLIPIDEMIA, HYPERCHOLESTEROLEMIA AND DIABETES NR1H2, RXRA, NR1H3 CYP1A2 187/4885TSHR 385/4885CYP2A6 234/4885

“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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