SCHEMBL3269705

SCHEMBL3269705

CCC1C=C(C(C)(C)C)C=C1[Zr](=C(c1ccccc1)c1ccccc1)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33
PNMT P11086 1/20 0.31

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
SCHEMBL5152992 0.91 NPC1 (0.31) NPC1RAB9A
SCHEMBL3477345 0.87 NPC1 (0.34) NPC1RAB9APNMT
Hydrochloric Acid SCHEMBL19133634 0.86 NPC1 (0.34) NPC1RAB9A
SCHEMBL3270906 0.83
SCHEMBL3275100 0.79
SCHEMBL3269121 0.79
Hydrochloric Acid SCHEMBL22607491 0.78 NPC1 (0.34) NPC1RAB9APNMT
SCHEMBL37569 0.78
Hydrochloric Acid SCHEMBL16949762 0.77
Hydrochloric Acid SCHEMBL675346 0.77 NPC1 (0.36) NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1803742-B1 PROCESS FOR PRODUCING PROPYLENE POLYMER MITSUI CHEMICALS INC (JP) 2010-06-23 EP disclosed
EP-1803742-A4 PROCESS FOR PRODUCING PROPYLENE POLYMER MITSUI CHEMICALS INC (JP) 2008-11-12 EP disclosed
WO-2006025540-A1 PROCESS FOR PRODUCING PROPYLENE POLYMER MITSUI CHEMICALS, INC. (JP) 2006-03-09 WO disclosed