SCHEMBL7603453

SCHEMBL7603453

CC[N+]1(C(=O)OC(C)(C)C)CCCCC1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.31
CTSK P43235 1/20 0.31

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
SCHEMBL1296518 0.85 HPGD (0.33) EPHX1CTSK
SCHEMBL6701925 0.83 EPHX1 (0.30) EPHX1CTSK
SCHEMBL1786719 0.83 EPHX1 (0.30) EPHX1CTSK
SCHEMBL2439447 0.82 CTSK (0.32) CTSK
SCHEMBL5797913 0.81 KDM4E (0.31)
SCHEMBL3982250 0.79 TDP1 (0.33) EPHX1CTSK
SCHEMBL9178020 0.79 BBOX1 (0.32) CTSK
SCHEMBL7477261 0.78 CTSK (0.32) CTSK
SCHEMBL2064367 0.75 HPGD (0.33) EPHX1CTSK
SCHEMBL27457847 0.74 CHRM2 (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3668889-A1 ECTOPIC OLFACTORY RECEPTORS AND USES THEREOF Aromyx Corporation (US) 2020-06-24 EP disclosed
WO-2019036432-A1 ECTOPIC OLFACTORY RECEPTORS ADN USES THEREOF Aromyx Corporation (US) 2019-02-21 WO disclosed
EP-1251856-A1 METHOD OF INCREASING ALERTNESS BY ADMINISTRATION OF A VOMEROPHERIN, AND VOMEROPHERIN-EMITTING ALARM DEVICES Pherin Pharmaceuticals, Inc. (US) 2002-10-30 EP disclosed
EP-1144431-A3 16-HYDROXYESTRATRIENES AS SELECTIVE ESTROGENS Schering Aktiengesellschaft (DE) 2002-06-12 EP disclosed
EP-1144431-A2 16-HYDROXYESTRATRIENES AS SELECTIVE ESTROGENS Schering Aktiengesellschaft (DE) 2001-10-17 EP disclosed
WO-2000047603-A9 16-HYDROXYESTRATRIENES AS SELECTIVE ESTROGENS SCHERING AG (DE) 2001-09-07 WO disclosed
WO-2001056577-A1 METHOD OF INCREASING ALERTNESS BY ADMINISTRATION OF A VOMEROPHERIN, AND VOMEROPHERIN-EMITTING ALARM DEVICES PHERIN PHARMACEUTICALS, INC. (US) 2001-08-09 WO disclosed
WO-2000047603-A2 16-HYDROXYESTRATRIENES AS SELECTIVE ESTROGENS SCHERING AKTIENGESELLSCHAFT (DE) 2000-08-17 WO disclosed