SCHEMBL7070632

SCHEMBL7070632

CCC1(CC)NC(C)(C)CN(Cc2ccccc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ELANE P08246 3/20 0.45
GAA P10253 1/20 0.44
EPHX2 P34913 1/20 0.43
DDB1 Q16531 1/20 0.43
CRBN Q96SW2 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
CYP2C19 P33261 4/20 0.42
RIPK1 Q13546 1/20 0.40
OPRM1 P35372 2/20 0.40
OPRL1 P41146 2/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CTSG P08311 1/20 0.39
PRTN3 P24158 1/20 0.39
AMPD2 Q01433 1/20 0.38

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
SCHEMBL5326926 0.77 GAA (0.46) ELANEGAAEPHX2DDB1CRBN
SCHEMBL7067422 0.77 ELANE (0.42) ELANEGAADDB1CRBNKMT2A
SCHEMBL10870338 0.75 ELANE (0.55) ELANEGAAEPHX2DDB1CRBN
SCHEMBL7068995 0.73 KMT2A (0.30) KMT2A
SCHEMBL7070545 0.72 ELANE (0.46) ELANEGAAEPHX2DDB1CRBN
SCHEMBL21225405 0.71 KMT2A (0.51) ELANEGAAEPHX2DDB1CRBN
SCHEMBL7070549 0.70 ELANE (0.44) ELANEGAAEPHX2DDB1CRBN
SCHEMBL21228482 0.70 KMT2A (0.50) ELANEGAAEPHX2DDB1CRBN
SCHEMBL11707747 0.70 GAA (0.61) GAAKMT2AMEN1CYP2C19ALDH1A1
SCHEMBL7071579 0.70 KDM4E (0.32) CRBNNPSR1CYP2C19

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-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