SCHEMBL6897223

SCHEMBL6897223

CC1=Cc2cc(C)ccc2C1[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 9)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
KCNK3 O14649 1/20 0.31
LMNA P02545 1/20 0.31
KCNK9 Q9NPC2 1/20 0.30
MRGPRX4 Q96LA9 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
NR1H4 Q96RI1 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
SCHEMBL6904422 0.90 NPC1 (0.34) CNR2NPC1RAB9A
SCHEMBL6904598 0.85 NPC1 (0.34) LMNANPC1RAB9A
SCHEMBL6904153 0.84 LMNA (0.32) LMNAKCNK9MRGPRX4
Hydrochloric Acid SCHEMBL17698633 0.83 LMNA (0.32) LMNA
SCHEMBL6907164 0.83 LMNA (0.31) CNR1CNR2LMNA
SCHEMBL6903956 0.83 ALDH1A1 (0.33) LMNAKCNK9MRGPRX4
SCHEMBL6899957 0.83 RAB9A (0.31) NPC1RAB9A
SCHEMBL6905967 0.81 NPC1 (0.34) LMNANPC1RAB9A
SCHEMBL6904015 0.81 NPC1 (0.31) CNR1CNR2NPC1RAB9A
SCHEMBL5078525 0.80 CNR1 (0.34) CNR1CNR2KCNK3LMNAKCNK9

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
EP-1473323-A1 Polyethylene composition and process for producing same Tosoh Corporation (JP) 2004-11-03 EP disclosed