SCHEMBL7753151

SCHEMBL7753151

C[Ti](C)([SiH3])(Cl)(Cl)(NC(=O)C1CCCCC1)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CYP2C19 P33261 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
HPGD P15428 1/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
P2RX7 Q99572 2/20 0.34
GAA P10253 1/20 0.34
KMT2A Q03164 2/20 0.33
HDAC1 Q13547 2/20 0.33
HDAC2 Q92769 2/20 0.33
MEN1 O00255 1/20 0.33
CETP P11597 1/20 0.33
HTR7 P34969 1/20 0.33
HTR2B P41595 1/20 0.33
HDAC3 O15379 1/20 0.33

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
SCHEMBL7752414 0.72 NPC1 (0.40) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL8676462 0.72 NPC1 (0.40) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL7753204 0.69 NPC1 (0.39) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL5853858 0.69 NPC1 (0.39) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL5856430 0.69 NPC1 (0.39) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL5853698 0.69 NPC1 (0.39) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL5854780 0.69 NPC1 (0.39) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL5854820 0.69 NPC1 (0.39) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL9064074 0.69 NPC1 (0.39) NPC1RAB9ACYP2C19SMN1; SMN2HPGD
SCHEMBL5855675 0.69 NPC1 (0.39) NPC1RAB9ACYP2C19SMN1; SMN2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0727443-B1 Catalyst for olefin polymerization and process for producing olefin polymers TOSOH CORP (JP) 2001-01-17 EP disclosed
US-5807938-A Catalyst for olefin polymerization and process for producing olefin polymers TOSOH CORPORATION (JP) 1998-09-15 US disclosed
EP-0730003-B1 Polypropylene resin composition and molded product TOSOH CORP (JP) 1997-12-29 EP disclosed
US-5608008-A ETHYLENE-A-OLEFIN COPOLYMER ELASTOMER TOSOH CORPORATION (JP) 1997-03-04 US disclosed
EP-0730003-A1 Polypropylene resin composition and molded product Tosoh Corporation (JP) 1996-09-04 EP disclosed
EP-0727443-A1 Catalyst for olefin polymerization and process for producing olefin polymers Tosoh Corporation (JP) 1996-08-21 EP disclosed