SCHEMBL6904422

SCHEMBL6904422

CC1=Cc2cc(C)ccc2C1[Zr](=C(c1ccccc1)c1ccccc1)C1c2cc(C)ccc2-c2ccc(C)cc21

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
PKM P14618 1/20 0.31
CNR2 P34972 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL6904598 0.92 NPC1 (0.34) NPC1RAB9APKMSMN1; SMN2
SCHEMBL6905967 0.91 NPC1 (0.34) NPC1RAB9APKM
SCHEMBL6899957 0.90 RAB9A (0.31) NPC1RAB9A
SCHEMBL6897223 0.90 CNR1 (0.32) NPC1RAB9ACNR2
SCHEMBL6903992 0.85 NPC1 (0.34) NPC1RAB9APKM
SCHEMBL5078596 0.83 NPC1 (0.30) NPC1RAB9A
SCHEMBL6904043 0.82 CNR2 (0.33) NPC1RAB9ACNR2
Hydrochloric Acid SCHEMBL19056232 0.82
SCHEMBL6904248 0.80 LMNA (0.34) NPC1RAB9ASMN1; SMN2
SCHEMBL6905822 0.79 NPC1 (0.33) NPC1RAB9ACNR2

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