SCHEMBL20440939

SCHEMBL20440939

CC1=CC(C(C)(C)C)=CC1[Zr](=C(c1ccccc1)c1ccccc1)C1c2cc(C(C)(C)C)ccc2-c2ccc(C(C)(C)C)cc21

nearest known ligand 0.32

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.31
MAPT P10636 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
NPC1 O15118 1/20 0.31
ALDH1A1 P00352 1/20 0.31
PLA2G1B P04054 1/20 0.31
NFKB1 P19838 1/20 0.31
CASP3 P42574 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SENP8 Q96LD8 1/20 0.31
SENP7 Q9BQF6 1/20 0.31
SENP6 Q9GZR1 1/20 0.31
ATG4B Q9Y4P1 1/20 0.31
TNF P01375 1/20 0.30
KLF5 Q13887 1/20 0.30
NOD1 Q9Y239 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
SCHEMBL6903134 0.83 L3MBTL1 (0.34) LMNAL3MBTL1MAPTTDP1NPC1
Hydrochloric Acid SCHEMBL19056278 0.82 L3MBTL1 (0.33) LMNAL3MBTL1MAPTTDP1NPC1
SCHEMBL6899736 0.81 LMNA (0.31) LMNAL3MBTL1MAPTTDP1NPC1
SCHEMBL5078525 0.80 CNR1 (0.34) LMNANPC1RAB9A
SCHEMBL20440972 0.80 L3MBTL1 (0.31) L3MBTL1MAPTTDP1NPC1ALDH1A1
SCHEMBL6905962 0.79 ALDH1A1 (0.32) LMNAALDH1A1TNFKLF5NOD1
SCHEMBL6898928 0.79 L3MBTL1 (0.33) L3MBTL1MAPTTDP1NPC1ALDH1A1
SCHEMBL6903966 0.78 LMNA (0.32) LMNAL3MBTL1NPC1ALDH1A1PLA2G1B
SCHEMBL6904165 0.77 L3MBTL1 (0.31) L3MBTL1MAPTTDP1NPC1ALDH1A1
SCHEMBL20440993 0.77 ALDH1A1 (0.34) LMNAL3MBTL1MAPTTDP1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10040883-B2 Multimodal polyolefin resin and molded product prepared therefrom DAELIM INDUSTRIAL CO., LTD. (KR) 2018-08-07 US disclosed