SCHEMBL2138043

SCHEMBL2138043

CC1=C([Si](C)(C)Cl)CC(c2ccccc2)=C1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.33
RAB9A P51151 3/20 0.33
HPGD P15428 2/20 0.32
APP P05067 1/20 0.32
CFTR P13569 1/20 0.31
GOPC Q9HD26 1/20 0.31
MEN1 O00255 1/20 0.31
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
KMT2A Q03164 1/20 0.31
BRD4 O60885 1/20 0.31
BRD2 P25440 1/20 0.31
POLB P06746 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGS1 P23219 1/20 0.30
PTGS2 P35354 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
SCHEMBL2139825 0.79 NOTUM (0.32)
SCHEMBL6287254 0.74 NPC1 (0.40) NPC1RAB9AHPGDAPPCFTR
SCHEMBL27519772 0.72 NPC1 (0.36) NPC1RAB9AHPGDAPPCFTR
SCHEMBL27521174 0.72 NPC1 (0.36) NPC1RAB9AHPGDAPPCFTR
SCHEMBL27898814 0.69 NPC1 (0.37) NPC1RAB9AHPGDAPPCFTR
SCHEMBL27394159 0.69 CFTR (0.40) NPC1RAB9AHPGDAPPCFTR
SCHEMBL27546185 0.69 ALDH1A1 (0.40) NPC1RAB9AHPGDCFTRGOPC
Hydrochloric Acid SCHEMBL8613341 0.68 NPC1 (0.36) NPC1RAB9AHPGDAPPCFTR
Hydrochloric Acid SCHEMBL27546000 0.68 HPGD (0.38) NPC1RAB9AHPGDAPPCFTR
Hydrochloric Acid SCHEMBL27522612 0.68 HPGD (0.38) NPC1RAB9AHPGDAPPCFTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2009017-B1 NOVEL TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION CONTAINING THE SAME, AND METHOD FOR PRODUCING PROPYLENE/ETHYLENE-ALPHA -OLEFIN BLOCK COPOLYMER BY USING THE CATALYST JAPAN POLYPROPYLENE CORP (JP) 2013-06-26 EP disclosed
US-7906599-B2 Transition metal compound, catalyst for olefin polymerization containing the same, and method for producing propylene/ethylene-α-olefin block copolymer by using the catalyst JAPAN POLYPROPYLENE CORPORATION (JP) 2011-03-15 US disclosed
US-20090099310-A1 NOVEL TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION CONTAINING THE SAME, AND METHOD FOR PRODUCING PROPYLENE/ETHYLENE-ALPHA-OLEFIN BLOCK COPOLYMER BY USING THE CATALYST JAPAN POLYPROPYLENE CORPORATION (JP) 2009-04-16 US disclosed
EP-2009017-A1 NOVEL TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION CONTAINING THE SAME, AND METHOD FOR PRODUCING PROPYLENE/ETHYLENE-ALPHA -OLEFIN BLOCK COPOLYMER BY USING THE CATALYST Japan Polypropylene Corporation (JP) 2008-12-31 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090099310-A1 NOVEL TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION CONTAINING THE SAME, AND METHOD FOR PRODUCING PROPYLENE/ETHYLENE-ALPHA-OLEFIN BLOCK COPOLYMER BY USING THE CATALYST ALOX12, ETFB, POF1B NPC1 3879/4885RAB9A 4373/4885HPGD 325/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.