SCHEMBL7626477

SCHEMBL7626477

C[SiH](C)[Zr](NC(=O)C1CCCCC1)(c1ccccc1)(c1ccccc1)c1cccc2c1Cc1ccccc1-2

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
HPGD P15428 1/20 0.36
CYP2C19 P33261 2/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 1/20 0.35
KCNK3 O14649 1/20 0.33
KCNK9 Q9NPC2 1/20 0.33
CCKAR P32238 1/20 0.33
CCKBR P32239 1/20 0.33
P2RX7 Q99572 2/20 0.33
LMNA P02545 1/20 0.33
GAA P10253 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL7628547 0.84 NPC1 (0.40) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL5854780 0.83 NPC1 (0.39) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL5855675 0.83 NPC1 (0.39) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL5852838 0.82 NPC1 (0.40) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL7633227 0.82 ALDH1A1 (0.39) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL5854766 0.78 HPGD (0.39) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL5854870 0.78 HPGD (0.39) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL5853516 0.76 HPGD (0.37) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL9587137 0.70 NPC1 (0.41) NPC1RAB9AHPGDCYP2C19ALDH1A1
SCHEMBL7636915 0.70 ALDH1A1 (0.39) NPC1RAB9AHPGDCYP2C19ALDH1A1

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-0849288-B1 Catalyst for polymerization of an olefin, and method for producing an olefin polymer TOSOH CORP (JP) 2002-11-27 EP disclosed
US-5906955-A Catalyst for polymerization of an olefin, and method for producing an olefin polymer TOSOH CORPORATION (JP) 1999-05-25 US disclosed
EP-0849288-A1 Catalyst for polymerization of an olefin, and method for producing an olefin polymer TOSOH CORPORATION (JP) 1998-06-24 EP disclosed