Ethane

Ethane

SCHEMBL4767713

CC.C[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H]1C(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.47
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
CHRM3 P20309 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.40
PREP P48147 2/20 0.39
USP2 O75604 1/20 0.39
GPR119 Q8TDV5 1/20 0.38
RECQL P46063 1/20 0.38

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
SCHEMBL6078167 1.00 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL627416 1.00 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL6078598 1.00 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL15719259 1.00 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL17598242 1.00 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL627415 1.00 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL883031 1.00 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL5955691 0.90 HSD17B10 (0.55) HSD17B10SMN1; SMN2HPGDPREP
SCHEMBL5579709 0.86 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2
SCHEMBL201852 0.86 HSD17B10 (0.47) HSD17B10CHRM2CHRM1CHRM3SMN1; SMN2

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
EP-1686996-A4 QUINAZOLINONE COMPOUNDS WITH REDUCED BIOACCUMULATION NOVARTIS VACCINES & DIAGNOSTIC (US) 2008-11-12 EP disclosed
US-7368453-B2 Quinazolinone compounds with reduced bioaccumulation CHIRON CORPORATION (US) 2008-05-06 US disclosed
EP-1686996-A1 QUINAZOLINONE COMPOUNDS WITH REDUCED BIOACCUMULATION CHIRON CORPORATION (US) 2006-08-09 EP disclosed
EP-1651229-A1 GUANIDINO-SUBSTITUTED QUINAZOLINONE COMPOUNDS AS MC4-R AGONISTS Chiron Corporation (US) 2006-05-03 EP disclosed
US-20050192297-A1 Quinazolinone compounds with reduced bioaccumulation CHIRON CORPORATION GLAXOSMITHKLINE 2005-09-01 US disclosed
WO-2005051391-A1 QUINAZOLINONE COMPOUNDS WITH REDUCED BIOACCUMULATION CHIRON CORPORATION (US) 2005-06-09 WO disclosed
WO-2004112793-A1 GUANIDINO-SUBSTITUTED QUINAZOLINONE COMPOUNDS AS MC4-R AGONISTS CHIRON CORPORATION (US) 2004-12-29 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-20050192297-A1 Quinazolinone compounds with reduced bioaccumulation MC4R, MC2R, MC3R HSD17B10 2843/4885CHRM2 79/4885CHRM1 51/4885

“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.