SCHEMBL7070549

SCHEMBL7070549

CCC1(CC)C(=O)N(Cc2ccccc2)CC(C)(C)N1O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.44
GAA P10253 1/20 0.43
RIPK1 Q13546 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
CYP2C19 P33261 4/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 2/20 0.41
POLB P06746 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
AMPD2 Q01433 2/20 0.40
DDB1 Q16531 1/20 0.39
CRBN Q96SW2 1/20 0.39
CTSG P08311 1/20 0.38
PRTN3 P24158 1/20 0.38
OPRM1 P35372 2/20 0.38
OPRL1 P41146 2/20 0.38
TSHR P16473 1/20 0.38
CASP3 P42574 1/20 0.37
EPHX2 P34913 1/20 0.37

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
SCHEMBL7070545 0.86 ELANE (0.46) ELANEGAARIPK1NPSR1CYP2C19
SCHEMBL5321206 0.77 GAA (0.45) ELANEGAARIPK1CYP2C19KMT2A
SCHEMBL4954884 0.77 ELANE (0.41) ELANEGAAKMT2AMEN1POLB
SCHEMBL13246448 0.77 GAA (0.47) ELANEGAARIPK1NPSR1CYP2C19
SCHEMBL4952383 0.75 BRD4 (0.30)
SCHEMBL10870338 0.74 ELANE (0.55) ELANEGAARIPK1NPSR1CYP2C19
SCHEMBL14372131 0.71 GAA (0.59) GAAKMT2AMEN1POLBCYP2D6
SCHEMBL7070632 0.70 ELANE (0.45) ELANEGAARIPK1NPSR1CYP2C19
SCHEMBL11165846 0.68 GAA (0.47) ELANEGAARIPK1NPSR1CYP2C19
SCHEMBL271991 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120313570-A1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE BATTERY, AND BATTERY PACK, ELECTRONIC APPLIANCE, ELECTRIC VEHICLE, ELECTRICITY STORAGE APPARATUS, AND ELECTRIC POWER SYSTEM EACH USING NONAQUEOUS ELECTROLYTE BATTERY SONY CORPORATION (JP) 2012-12-13 US disclosed
US-20120313570-A1 NONAQUEOUS ELECTROLYTE AND NONAQUEOUS ELECTROLYTE BATTERY, AND BATTERY PACK, ELECTRONIC APPLIANCE, ELECTRIC VEHICLE, ELECTRICITY STORAGE APPARATUS, AND ELECTRIC POWER SYSTEM EACH USING NONAQUEOUS ELECTROLYTE BATTERY SONY CORPORATION (JP) 2012-12-13 US disclosed
US-6664353-B2 Compounds providing stable free radical-mediated polymerization processes which yield polymers having low polydispersity at enhanced rates of polymerization and enhanced monomer to polymer conversions CIBA SPECIALTY CHEMICALS CORPORATION 2003-12-16 US disclosed
US-20030125494-A1 Heterocyclic alkoxyamines as regulators in controlled radical polymerization processes NESVADBA PETER (CH) 2003-07-03 US disclosed
US-6479608-B1 Heterocyclic alkoxyamines as regulators in controlled radical polymerization processes CIBA SPECIALTY CHEMICALS CORPORATION 2002-11-12 US disclosed