SCHEMBL7101276

SCHEMBL7101276

CC(C)CN=Cc1ccccc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 7/20 0.63
CA2 P00918 7/20 0.63
KDM4E B2RXH2 5/20 0.63
CA9 Q16790 6/20 0.59
RAB9A P51151 2/20 0.51
NPC1 O15118 1/20 0.51
ALDH1A1 P00352 5/20 0.50
MAPT P10636 5/20 0.50
SIRT2 Q8IXJ6 1/20 0.48
KMT2A Q03164 3/20 0.47
ALOX15 P16050 3/20 0.45
GAA P10253 3/20 0.45
HPGD P15428 3/20 0.45
POLB P06746 2/20 0.45
HSD17B10 Q99714 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
USP2 O75604 1/20 0.45
ALOX12 P18054 1/20 0.45
RECQL P46063 1/20 0.45
THRB P10828 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
SCHEMBL16317121 1.00 CA12 (0.63) CA12CA2KDM4ECA9RAB9A
SCHEMBL711079 0.88 KDM4E (0.61) CA12CA2KDM4ECA9RAB9A
SCHEMBL145541 0.88 KDM4E (0.61) CA12CA2KDM4ECA9RAB9A
SCHEMBL1270639 0.88 KDM4E (0.61) CA12CA2KDM4ECA9RAB9A
SCHEMBL9437414 0.88 KDM4E (0.61) CA12CA2KDM4ECA9RAB9A
SCHEMBL29365933 0.88 KDM4E (0.61) CA12CA2KDM4ECA9RAB9A
SCHEMBL25650142 0.88 KDM4E (0.61) CA12CA2KDM4ECA9RAB9A
SCHEMBL16875822 0.86 CA12 (0.59) CA12CA2KDM4ECA9RAB9A
SCHEMBL30511970 0.86 CA12 (0.59) CA12CA2KDM4ECA9RAB9A
SCHEMBL13186635 0.86 CA12 (0.59) CA12CA2KDM4ECA9RAB9A

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
EP-0988330-B1 METHOD FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE/NORBORNENE-TYPE MONOMERS WITH NICKEL CATALYSTS SUMITOMO BAKELITE CO (JP) 2003-09-03 EP disclosed
US-6197984-B1 Method for the preparation of copolymers of ethylene/norbornene-type monomers with nickel catalysts THE B. F. GOODRICH COMPANY 2001-03-06 US disclosed
EP-0988330-A1 METHOD FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE/NORBORNENE-TYPE MONOMERS WITH NICKEL CATALYSTS THE B.F. GOODRICH COMPANY (US) 2000-03-29 EP disclosed
US-5929181-A Method for preparation of copolymers of ethylene/norbornene-type monomers with nickel catalysts THE B.F.GOODRICH CO. (US) 1999-07-27 US disclosed
WO-1998056837-A1 METHOD FOR THE PREPARATION OF COPOLYMERS OF ETHYLENE/NORBORNENE-TYPE MONOMERS WITH NICKEL CATALYSTS THE B.F. GOODRICH COMPANY (US) 1998-12-17 WO disclosed