SCHEMBL4455948

SCHEMBL4455948

CCOC(=O)N(CCCc1ccccc1)C1CCCCC1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.61
POLB P06746 1/20 0.48
PKM P14618 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
SLC18A3 Q16572 1/20 0.46
OPRM1 P35372 5/20 0.46
ALOX5 P09917 1/20 0.45
MAOA P21397 2/20 0.45
MAOB P27338 2/20 0.45
NISCH Q9Y2I1 2/20 0.44

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
SCHEMBL10988348 0.79 ALDH1A1 (0.44) L3MBTL1LMNA
SCHEMBL20166075 0.78 L3MBTL1 (0.41) L3MBTL1LMNA
SCHEMBL13351506 0.78 OPRM1 (0.70) L3MBTL1PKMOPRM1MAOAMAOB
Encyprate SCHEMBL122353 0.77 L3MBTL1 (0.55) L3MBTL1POLBLMNAOPRM1
SCHEMBL5987370 0.77 ALOX5 (0.47) L3MBTL1POLBPKMLMNAMAPT
SCHEMBL10990804 0.77 ALDH1A1 (0.40) L3MBTL1LMNA
SCHEMBL5689582 0.77 CHRM5 (0.44) L3MBTL1
Hydrochloric Acid SCHEMBL27493502 0.77 L3MBTL1 (0.53) L3MBTL1SLC18A3OPRM1MAOAMAOB
SCHEMBL13684267 0.76 L3MBTL1 (0.63) L3MBTL1
SCHEMBL31126845 0.76 CYP1A2 (0.41) L3MBTL1ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7622526-B2 Thermoset material based on antiplasticizing polythiourethane and ophthalmic lens comprising an antiplasticized thermoset material ESSILOR INTERNATIONAL (FR) 2009-11-24 US disclosed
EP-1670852-B1 THERMOSETTING MATERIAL BASED ON ANTIPLASTICIZED POLYTHIOURETHANE, AND OPHTHALMIC LENS COMPRISING AN ANTIPLASTICIZED THERMOSETTING MATERIAL ESSILOR INT (FR) 2008-12-10 EP disclosed
US-20060270771-A1 Thermoset material based on antiplasticizing polythiourethane and ophthalmic lens comprising an antiplasticized thermoset material ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) 2006-11-30 US disclosed