SCHEMBL137373

SCHEMBL137373

CCC1=Cc2c(-c3ccccc3)cccc2C1[Zr](Cl)(Cl)(=C(c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1)C1C(CC)=Cc2c(-c3ccccc3)cccc21

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
GRIN2C Q14957 1/20 0.34
NR1H4 Q96RI1 4/20 0.32
CCKAR P32238 1/20 0.32
CCKBR P32239 1/20 0.32
RAB9A P51151 4/20 0.32
NPC1 O15118 3/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
ALDH1A1 P00352 1/20 0.32
GLA P06280 1/20 0.32
ATM Q13315 1/20 0.32
KCNK9 Q9NPC2 1/20 0.32
TP53 P04637 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
FFAR2 O15552 1/20 0.31
LMNA P02545 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
SCHEMBL140544 0.92 CCKAR (0.33) GRIN2CNR1H4CCKARCCKBRRAB9A
SCHEMBL140970 0.90 PDCD1 (0.31) L3MBTL1
SCHEMBL137810 0.88 LMNA (0.37) RAB9ANPC1L3MBTL1MAPK1LMNA
SCHEMBL143517 0.87 LMNA (0.36) RAB9ANPC1L3MBTL1MAPK1LMNA
SCHEMBL141098 0.87 GRIN2C (0.35) GRIN2CNR1H4CCKARCCKBRRAB9A
SCHEMBL6465005 0.84 NR1H4 (0.30) NR1H4
SCHEMBL143669 0.81 SMN1; SMN2 (0.31)
SCHEMBL144096 0.81 PDCD1 (0.32)
SCHEMBL6466760 0.80 BRD4 (0.31)
SCHEMBL142312 0.80 LMNA (0.36) L3MBTL1MAPK1LMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2415792-B1 COPOLYMER OF OLEFIN AND CONJUGATED DIENE, AND PROCESS FOR PRODUCING SAME MITSUI CHEMICALS INC (JP) 2014-11-12 EP disclosed
US-8513368-B2 Copolymer of olefin and conjugated diene, and process for producing the same MITSUI CHEMICALS, INC. (JP) 2013-08-20 US disclosed
US-20120059135-A1 COPOLYMER OF OLEFIN AND CONJUGATED DIENE, AND PROCESS FOR PRODUCING THE SAME MITSUI CHEMICALS, INC. (JP) 2012-03-08 US disclosed
EP-2415792-A1 COPOLYMER OF OLEFIN AND CONJUGATED DIENE, AND PROCESS FOR PRODUCING SAME Mitsui Chemicals, Inc. (JP) 2012-02-08 EP disclosed