SCHEMBL7928734

SCHEMBL7928734

CC(C)(C)C(=O)O[Ti](C)(C)(=[SiH2])(OC(=O)C(C)(C)C)(C1=CC=CC1)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
HTR7 P34969 1/20 0.34
HTR2B P41595 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
SCHEMBL7925585 0.90 NPC1 (0.34) NPC1RAB9AHTR7HTR2B
SCHEMBL7925780 0.89 RAB9A (0.40) NPC1RAB9AHTR7HTR2B
SCHEMBL7927235 0.88 RAB9A (0.43) NPC1RAB9AHTR7HTR2B
SCHEMBL7919108 0.87 NPC1 (0.36) NPC1RAB9AHTR7HTR2B
SCHEMBL8158143 0.87 NPC1 (0.36) NPC1RAB9AHTR7HTR2B
SCHEMBL7925609 0.86 NPC1 (0.37) NPC1RAB9AHTR7HTR2B
SCHEMBL7927841 0.86 RAB9A (0.35) NPC1RAB9AHTR7HTR2B
SCHEMBL7930302 0.86 NPC1 (0.35) NPC1RAB9AHTR7HTR2B
SCHEMBL7925497 0.86 NPC1 (0.35) NPC1RAB9AHTR7HTR2B
SCHEMBL7930965 0.84 MAPT (0.34) NPC1RAB9AHTR7HTR2B

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-0867454-B1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN CO (JP) 2001-03-21 EP disclosed
US-6075102-A Polymerization catalyst and process for producing polymers IDEMITSU KOSAN CO., LTD. (JP) 2000-06-13 US disclosed
EP-0867454-A1 POLYMERIZATION CATALYST AND PROCESS FOR PRODUCING POLYMERS IDEMITSU KOSAN COMPANY LIMITED (JP) 1998-09-30 EP disclosed