SCHEMBL2855722

SCHEMBL2855722

CC1=C(C)C([Zr](Cl)(Cl)(=C(c2ccccc2)c2ccccc2)C2c3cc(C(C)(C)C)ccc3-c3ccc(C(C)(C)C)cc32)c2ccccc21

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.33
ALDH1A1 P00352 2/20 0.33
CASP3 P42574 2/20 0.33
RAB9A P51151 2/20 0.33
SENP8 Q96LD8 2/20 0.33
SENP7 Q9BQF6 2/20 0.33
SENP6 Q9GZR1 2/20 0.33
PLA2G1B P04054 1/20 0.33
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ATG4B Q9Y4P1 1/20 0.33
LMNA P02545 1/20 0.31
KCNK9 Q9NPC2 1/20 0.31
GLA P06280 1/20 0.30
MAPK1 P28482 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL2857526 0.87 MEN1 (0.31) LMNA
SCHEMBL2863579 0.86 MEN1 (0.32) NPC1RAB9ALMNA
SCHEMBL2862555 0.83 NPC1 (0.33) NPC1ALDH1A1RAB9AL3MBTL1LMNA
SCHEMBL2861547 0.81 CA12 (0.31) LMNAKCNK9
SCHEMBL2868592 0.81 NPC1 (0.32) NPC1ALDH1A1CASP3RAB9ASENP8
SCHEMBL2863640 0.79 KCNK9 (0.30) KCNK9
SCHEMBL22607487 0.79 KCNK9 (0.33) NPC1ALDH1A1CASP3RAB9ASENP8
SCHEMBL2860772 0.79 ALDH1A1 (0.31) ALDH1A1LMNAKCNK9
SCHEMBL21980370 0.78 LMNA (0.31) NPC1ALDH1A1CASP3RAB9ASENP8
SCHEMBL2872427 0.78 NPC1 (0.31) NPC1ALDH1A1CASP3RAB9ASENP8

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-1964860-B1 ETHYLENE POLYMER, CATALYST FOR PRODUCTION OF ETHYLENE POLYMER, AND PROCESS FOR PRODUCTION OF ETHYLENE POLYMER TOSOH CORP (JP) 2017-07-05 EP disclosed
US-7838611-B2 Ethylene polymer, catalyst for ethylene polymer production, and method for producing ethylene polymer TOSOH CORPORATION (JP) 2010-11-23 US disclosed
US-7678866-B2 Polyethylene composition and process for producing same TOSOH CORPORATION (JP) 2010-03-16 US disclosed
US-20090137755-A1 ETHYLENE POLYMER, CATALYST FOR ETHYLENE POLYMER PRODUCTION, AND METHOD FOR PRODUCING ETHYLENE POLYMER TOSOH CORPORATION (JP) 2009-05-28 US disclosed
US-20040214953-A1 Polyethylene composition and process for producing same TOSOH CORPORATION 2004-10-28 US disclosed