SCHEMBL4986264

SCHEMBL4986264

CC(CON1C(C)(C)CC(O)CC1(C)C)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.38
TAAR1 Q96RJ0 2/20 0.35
TRPA1 O75762 3/20 0.35
CYP2D6 P10635 1/20 0.34
TSHR P16473 2/20 0.34
HSD11B1 P28845 1/20 0.34
ALDH1A1 P00352 2/20 0.33
OPRM1 P35372 1/20 0.33
OPRD1 P41143 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
KDM4E B2RXH2 1/20 0.33
GFER P55789 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL7743245 0.87 ALOX15 (0.41) KMT2ACYP2D6OPRM1OPRD1KDM4E
SCHEMBL4982859 0.81 TAAR1 (0.38) TAAR1TRPA1ALDH1A1KDM4EGFER
SCHEMBL6809943 0.78 KMT2A (0.37) KMT2ACYP2D6TSHRHSD11B1OPRM1
SCHEMBL13008873 0.77 SLC6A2 (0.38) KMT2ACYP2D6TSHROPRM1OPRD1
SCHEMBL13008743 0.76 KMT2A (0.33) KMT2ACYP2D6
SCHEMBL8182568 0.75 KMT2A (0.35) KMT2ACYP2D6
SCHEMBL3627121 0.74 GSR (0.38) KMT2ACYP2D6TSHR
SCHEMBL4985361 0.74 DHFR (0.41) KMT2ATSHRALDH1A1KDM4E
SCHEMBL886985 0.73 KMT2A (0.35) KMT2ACYP2D6TSHRHSD11B1OPRM1
SCHEMBL4801749 0.73 KMT2A (0.35) KMT2ACYP2D6TSHRHSD11B1OPRM1

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-7388052-B2 Process for the preparation of block copolymers POLIMERI EUROPA S.P.A. (IT) 2008-06-17 US disclosed
EP-1519970-B1 PROCESS FOR THE PREPARATION OF BLOCK COPOLYMERS POLIMERI EUROPA SPA (IT) 2007-10-24 EP disclosed
US-20070219329-A1 polymerizing styrene using a nitroxy free radical catalyst, then adding methacrylonitrile; 2-methyl-2-(2,2,6,6-tetramethylpiperidin-1-yloxy)propionitrile catalyst; POLIMERI EUROPA S.P.A. (IT) 2007-09-20 US disclosed