SCHEMBL27437360

SCHEMBL27437360

COc1ccccc1O[Zr](Oc1ccccc1OC)(C1C=CC=C1)C1C=CC=C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA12 O43570 1/20 0.50
CA4 P22748 1/20 0.50
CA14 Q9ULX7 1/20 0.50
ALDH1A1 P00352 3/20 0.41
HTT P42858 2/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
MAPK1 P28482 1/20 0.41
CHRNB4 P30926 1/20 0.38
CHRNA3 P32297 1/20 0.38
TDP1 Q9NUW8 2/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
ADRA2B P18089 1/20 0.38
PTGS1 P23219 1/20 0.38
ENPP2 Q13822 1/20 0.35
ORAI1 Q96D31 1/20 0.34

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
SCHEMBL27432131 0.81 KCNH2 (0.31)
SCHEMBL27536849 0.81 TSHR (0.37) ALDH1A1TDP1TSHRSMN1; SMN2KMT2A
SCHEMBL27454424 0.78 SLC6A2 (0.41) ALDH1A1HTTL3MBTL1MAPK1TSHR
SCHEMBL28745876 0.78 PTGS2 (0.45) ALDH1A1HTTL3MBTL1MAPK1TDP1
SCHEMBL27545243 0.77 FABP7 (0.31)
SCHEMBL27547738 0.77 LMNA (0.36) ALDH1A1HTTL3MBTL1TDP1TSHR
SCHEMBL27436282 0.77 HTR1A (0.34) ALDH1A1L3MBTL1TDP1SMN1; SMN2MAPT
SCHEMBL27545375 0.77 HTR7 (0.33)
SCHEMBL28745888 0.77 SMN1; SMN2 (0.34) L3MBTL1TDP1TSHRPOLBSMN1; SMN2
SCHEMBL27455081 0.77 L3MBTL1 (0.42) ALDH1A1L3MBTL1TSHRADRA2BMGLL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1128817-C Solid catalyst for olefin polymerization and process for producing olefin polymer using the same MARUZEN PETROCHEM CO LTD (JP) 2003-11-26 CN disclosed
CN-1259963-A Catalytic components for polymerization of olefins, catalyst and process for the polymerization MARUZEN PETROCHEM CO LTD (JP) 2000-07-12 CN disclosed