SCHEMBL4468420

SCHEMBL4468420

CC1=Cc2cccc(-c3ccc(C(C)(C)C)cc3)c2C1[Si](C)(C)Cl

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTAFR P25105 1/20 0.36
NPC1 O15118 4/20 0.35
RAB9A P51151 4/20 0.35
LMNA P02545 1/20 0.35
TP53 P04637 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KIF11 P52732 2/20 0.35
S1PR1 P21453 1/20 0.35
NR1H4 Q96RI1 3/20 0.33
TSHR P16473 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
DGAT1 O75907 2/20 0.32
KDM4E B2RXH2 1/20 0.31
HTT P42858 1/20 0.30
MEN1 O00255 1/20 0.30
NR2F2 P24468 1/20 0.30
KMT2A Q03164 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 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
SCHEMBL1024509 0.86 PTAFR (0.34) PTAFRNPC1RAB9ALMNATP53
SCHEMBL5086245 0.83 PTAFR (0.34) PTAFRNPC1RAB9ALMNATP53
SCHEMBL27199723 0.80 TSHR (0.37) PTAFRNPC1RAB9ALMNATP53
SCHEMBL5690313 0.80 BRD4 (0.38) PTAFRNPC1RAB9ALMNATP53
SCHEMBL2388282 0.80 NPC1 (0.35) PTAFRNPC1RAB9ALMNATP53
Hydrochloric Acid SCHEMBL5697214 0.79 KIF11 (0.37) PTAFRNPC1RAB9ALMNATP53
SCHEMBL1799580 0.72 NPC1 (0.33) PTAFRNPC1RAB9ALMNATP53
SCHEMBL30541994 0.72 NPC1 (0.33) PTAFRNPC1RAB9ALMNATP53
SCHEMBL1455223 0.71 NPC1 (0.36) PTAFRNPC1RAB9ALMNATP53
SCHEMBL5689983 0.71 BRD4 (0.36) PTAFRNPC1RAB9ALMNATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124618-A1 Asymmetric Constrained Geometry Catalysts EXXONMOBIL CHEMICAL PATENTS INC (US) 2024-04-18 US disclosed
US-11802170-B2 Polyolefins prepared with binuclear metallocene catalysts EXXONMOBIL CHEMICAL PATENTS INC. (US) 2023-10-31 US disclosed
US-20220372178-A1 Polyolefins Prepared with Binuclear Metallocene Catalysts EXXONMOBIL CHEMICAL PATENTS INC. 2022-11-24 US disclosed
EP-1548023-B1 Transition metal compound, catalyst system and the use of the latter for the polymerisation and copolymerisation of olefins BASELL POLYOLEFINE GMBH (DE) 2013-08-14 EP disclosed
US-7569651-B2 Transition metal compound, ligand system, catalyst system and its use for the polymerization and copolymerization of olefins BASELL POLYPROPYLEN GMBH (DE) 2009-08-04 US disclosed
US-7342078-B2 Transition metal compound, ligand system, catalyst system and the use of the latter for polymerisation and copolymerisation of olefins BASELL POLYOLEFINE GMBH (DE) 2008-03-11 US disclosed
US-20060020096-A1 Transition metal compound, ligand system, catalyst system and its use for the polymerization and copolymerization of olefins SCHOTTEK JORG 2006-01-26 US disclosed
EP-1548037-A2 Random propylene-ethylene copolymers Basell Polyolefine GmbH (DE) 2005-06-29 EP disclosed
EP-1548022-A2 Transition metal compound, ligand system, catalyst system and the use of the latter for the polymerisation and copolymerisation of olefins Basell Polyolefine GmbH (DE) 2005-06-29 EP disclosed
EP-1548023-A2 Transition metal compound, catalyst system and the use of the latter for the polymerisation and copolymerisation of olefins Basell Polyolefine GmbH (DE) 2005-06-29 EP disclosed
US-20030149199-A1 Transition metal compound, ligand system, catalyst system and the use of the latter for polymerisation and copolymerisation of olefins BASELL POLYPROPYLEN GMBH (DE) 2003-08-07 US 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 (3 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-11802170-B2 Polyolefins prepared with binuclear metallocene catalysts C1S, C9, C5 PTAFR 1184/4885NPC1 3585/4885RAB9A 3673/4885
US-20240124618-A1 Asymmetric Constrained Geometry Catalysts GNE, ESR1, PGR PTAFR 2966/4885NPC1 3941/4885RAB9A 4202/4885
US-20030149199-A1 Transition metal compound, ligand system, catalyst system and the use of the latter for polymerisation and copolymerisation of olefins PORCN, PGR, PPOX PTAFR 818/4885NPC1 4292/4885RAB9A 4819/4885

“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.