SCHEMBL7113244

SCHEMBL7113244

CC(=O)NCCOc1ccc2c(c1)[nH]c1ccccc12

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.59
MTNR1A P48039 7/20 0.57
MTNR1B P49286 7/20 0.57
KDM4E B2RXH2 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 2/20 0.50
HPGD P15428 1/20 0.50
USP2 O75604 1/20 0.50
ALOX15 P16050 1/20 0.50
TSHR P16473 1/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50
KIF11 P52732 2/20 0.49
PDK2 Q15119 1/20 0.48
CTSV O60911 1/20 0.48
CTSL P07711 1/20 0.48

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
SCHEMBL7110432 0.81 L3MBTL1 (0.60) LMNAKDM4EL3MBTL1CTSVCTSL
SCHEMBL7107120 0.81 CA12 (0.53) KDM4EKIF11PDK2
SCHEMBL16549979 0.79 KDM4E (0.58) MTNR1AMTNR1BKDM4EHPGDMAPK1
SCHEMBL16792082 0.78 ADRB2 (0.53) KDM4EALDH1A1KIF11CTSVCTSL
SCHEMBL16790723 0.78 GABRP (0.61) KDM4EALDH1A1HPGDTSHRMAPK1
SCHEMBL12886607 0.78 MAOA (0.57) KDM4EALDH1A1HPGDHSD17B10KIF11
SCHEMBL12722429 0.78 GABRP (0.58) LMNAKDM4EALDH1A1HPGDTSHR
SCHEMBL7803694 0.77 CTSV (0.54) KIF11CTSVCTSL
SCHEMBL13394717 0.77 KIF11 (0.57) KDM4EALDH1A1HPGDMAPK1HSD17B10
SCHEMBL9625788 0.77 KIF11 (0.57) KDM4EALDH1A1HPGDHSD17B10KIF11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0882707-B1 NOVEL TRICYCLIC COMPOUNDS AND DRUG COMPOSITIONS CONTAINING THE SAME ASAHI CHEMICAL IND (JP) 2003-10-08 EP disclosed
US-20030139475-A1 Novel tricyclic compounds and drug compositions containing same ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2003-07-24 US disclosed
US-6545053-B1 Aminoethoxyfluorene derivatives are beta-3 adrenaline receptor agonists and are useful as drugs for the treatment and prevention of diabetes, obesity, hyperlipemia, etc. ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2003-04-08 US disclosed
US-6187809-B1 BETA-3 ADRENALINE RECEPTOR AGONIST DRUGS FOR THE TREATMENT OF DIABETES, OBESITY, AND HYPERLIPEMIA; 2-(N-(2-(DIBENZOFURAN-3-YLOXY)ETHYL)AMINO)-1-PHENYLETHANOL, FOR EXAMPLE ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2001-02-13 US disclosed
US-6037362-A CARBAZOLE DERIVATIVES; DEPROTECTING, AMINATION; ANTILIPEMIC AND ANTIDIABETIC AGENTS; B-ADRENALINE RECEPTOR AGONISTS; DIETETICS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2000-03-14 US disclosed
EP-0882707-A1 NOVEL TRICYCLIC COMPOUNDS AND DRUG COMPOSITIONS CONTAINING THE SAME Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1998-12-09 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 (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-20030139475-A1 Novel tricyclic compounds and drug compositions containing same ADRB3, MC2R, NR3C1 LMNA 3391/4885MTNR1A 109/4885MTNR1B 150/4885

“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.