SCHEMBL912304

SCHEMBL912304

COC(=O)C[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 8/20 0.47
BTK Q06187 1/20 0.47
EPHX1 P07099 1/20 0.44
KDM1A O60341 1/20 0.44
MAOB P27338 1/20 0.44
CTSK P43235 2/20 0.43
DRD3 P35462 2/20 0.43
GAA P10253 1/20 0.42
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
EPHX2 P34913 1/20 0.40

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
SCHEMBL912303 1.00 DRD2 (0.47) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL13202379 1.00 DRD2 (0.47) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL22844241 0.91 BTK (0.51) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL227251 0.87 DRD2 (0.45) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL227250 0.87 DRD2 (0.45) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL25918883 0.87 DRD2 (0.45) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL6883509 0.86 DRD2 (0.48) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL6883508 0.86 DRD2 (0.48) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL622419 0.86 BTK (0.51) DRD2BTKEPHX1KDM1AMAOB
SCHEMBL1543495 0.86 BTK (0.51) DRD2BTKEPHX1KDM1AMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2094267-B1 4-(1-AMINO-ETHYL)-CYCLOHEXYLAMINE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2015-04-22 EP disclosed
US-8247441-B2 Chromene compounds, a process for their preparation and pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2012-08-21 US disclosed
US-8044044-B2 4-(1-amino-ethyl)-cyclohexylamine derivatives ACTELION PHARMACEUTICAL LTD. (CH) 2011-10-25 US disclosed
US-20110021490-A1 Chromene compounds, a process for their preparationand pharmaceutical compositions containing them LES LABORATOIRES SERVIER (FR) 2011-01-27 US disclosed
US-20100029623-A1 4-(1-AMINO-ETHYL)-CYCLOHEXYLAMINE DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-02-04 US disclosed
EP-1489078-B1 BENZOFURAN DERIVATIVE MITSUBISHI TANABE PHARMA CORP (JP) 2010-01-06 EP disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 US disclosed
US-7531537-B2 Benzofuran derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-05-12 US disclosed
EP-1966142-A2 NEW PHENANTHRIDINE DERIVATIVES AS BRADYKININ ANTAGONISTS Richter Gedeon NYRT (HU) 2008-09-10 EP disclosed
WO-2007072092-A2 NEW PHENANTHRIDINE DERIVATIVES AS BRADYKININ ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2007-06-28 WO disclosed
US-20050282808-A1 Benzofuran derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2005-12-22 US disclosed
EP-1489078-A1 BENZOFURAN DERIVATIVE Tanabe Seiyaku Co., Ltd. (JP) 2004-12-22 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 (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-20050282808-A1 Benzofuran derivative F12, F2, F11 DRD2 2069/4885BTK 25/4885EPHX1 3082/4885
US-20090209511-A1 Benzofuran Derivatives F12, F2, F3 DRD2 2276/4885BTK 24/4885EPHX1 3031/4885
US-20100029623-A1 4-(1-AMINO-ETHYL)-CYCLOHEXYLAMINE DERIVATIVES AHR, KRAS, CNKSR1 DRD2 53/4885BTK 2517/4885EPHX1 2373/4885
US-20110021490-A1 Chromene compounds, a process for their preparationand pharmaceutical compositions containing them CHRM3, CCKAR, ADRB3 DRD2 239/4885BTK 1359/4885EPHX1 1734/4885

“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.