SCHEMBL5518642

SCHEMBL5518642

C[Si](C)(C)CCOCn1nc([Sn](C)(C)C)c2cc(Cl)ccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.36
MAPT P10636 1/20 0.34
DGAT1 O75907 2/20 0.31
PLK1 P53350 1/20 0.31
PTPN1 P18031 1/20 0.31
MCL1 Q07820 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
AKR1B1 P15121 1/20 0.30
MAPK8 P45983 3/20 0.30
MAPK9 P45984 2/20 0.30
MAPK10 P53779 2/20 0.30
MAP4K4 O95819 1/20 0.30
CSF1R P07333 1/20 0.30
PIM1 P11309 1/20 0.30
CLK2 P49760 1/20 0.30
MAP4K2 Q12851 1/20 0.30
MINK1 Q8N4C8 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
SCHEMBL5511811 0.82 NPC1 (0.37) NPC1MAPTDGAT1PLK1PTPN1
SCHEMBL30855567 0.82 NPC1 (0.43) NPC1DGAT1
SCHEMBL15574301 0.82 NPC1 (0.43) NPC1DGAT1
SCHEMBL31391652 0.81 DGAT1 (0.35) NPC1DGAT1
SCHEMBL28999474 0.81 DGAT1 (0.35) NPC1DGAT1
SCHEMBL29132219 0.79 LRRK2 (0.35) NPC1DGAT1
SCHEMBL31459935 0.76 KMO (0.37) NPC1MAPTDGAT1PTPN1
SCHEMBL5523225 0.75 ENPP2 (0.37) NPC1MAPTAKR1B1
SCHEMBL14493369 0.75 ENPP2 (0.37) NPC1MAPTAKR1B1
SCHEMBL6486540 0.75 KMO (0.36) NPC1MAPTDGAT1PTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7232912-B2 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. (US) 2007-06-19 US disclosed
US-20060111322-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. 2006-05-25 US disclosed
US-20050239855-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. 2005-10-27 US disclosed
US-6919461-B2 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. (US) 2005-07-19 US disclosed
US-20030139463-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation REICH SIEGFRIED HEINZ (US) 2003-07-24 US disclosed
US-6555539-B2 For treating cancer and other disease states associated with unwanted angiogenesis and/or cellular proliferation such as diabetic retinopathy, neovascular glaucoma, rheumatoid arthritis, psoriasis AGOURON PHARMACEUTICALS 2003-04-29 US disclosed
US-20020161022-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS 2002-10-31 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 (4 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-20050239855-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 NPC1 2507/4885MAPT 902/4885DGAT1 2741/4885
US-20020161022-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 NPC1 2507/4885MAPT 902/4885DGAT1 2741/4885
US-20030139463-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 NPC1 2507/4885MAPT 902/4885DGAT1 2741/4885
US-20060111322-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation MKI67, CCNI, CDK3 NPC1 244/4885MAPT 2542/4885DGAT1 1650/4885

“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.