SCHEMBL2870404

SCHEMBL2870404

CC1=CC([Zr](Cl)(Cl)(=C(c2ccccc2)c2ccccc2)C2c3ccccc3-c3ccccc32)c2ccc(C)cc21

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
PPIA P62937 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C9 P11712 1/20 0.32
CRHBP P24387 1/20 0.32
CYP2C19 P33261 1/20 0.32
ATM Q13315 1/20 0.32
CRHR2 Q13324 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
LMNA P02545 2/20 0.31
S1PR4 O95977 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
SCHEMBL2871024 0.93 NPC1 (0.32) NPC1RAB9AS1PR4
SCHEMBL2863298 0.91 NPC1 (0.32) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL2867900 0.91 NPC1 (0.32) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL2861168 0.90
SCHEMBL2862080 0.86
SCHEMBL2866152 0.86 KCNK3 (0.31)
SCHEMBL2861631 0.85 NPC1 (0.33) NPC1RAB9A
SCHEMBL2864617 0.82 MYC (0.32) ATM
SCHEMBL2863958 0.82 HSP90AA1 (0.30) ATM
SCHEMBL2861426 0.82 ALOX15 (0.31) NPC1RAB9AS1PR4

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-1473323-B1 Polyethylene composition and process for producing same TOSOH CORP (JP) 2016-04-27 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