SCHEMBL5522745

SCHEMBL5522745

COc1cccc(-c2ccc3c(c2)c(-c2nc4ccccc4n2COCC[Si](C)(C)C)nn3COCC[Si](C)(C)C)c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.44
ALDH1A1 P00352 8/20 0.44
MAPT P10636 7/20 0.44
SMN1; SMN2 Q16637 6/20 0.44
TP53 P04637 5/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
TSHR P16473 5/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
HSD17B10 Q99714 6/20 0.42
HPGD P15428 4/20 0.42
MAPK1 P28482 1/20 0.42
LMNA P02545 5/20 0.40
HTT P42858 5/20 0.39
NPSR1 Q6W5P4 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
CNR2 P34972 1/20 0.39
GAA P10253 1/20 0.39
RECQL P46063 1/20 0.39

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
SCHEMBL5518836 0.91 KDM4E (0.44) KDM4EALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL5512298 0.85 MAPT (0.41) KDM4EALDH1A1MAPTSMN1; SMN2RAB9A
SCHEMBL3538698 0.83 HSD17B10 (0.43) KDM4EALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL5518847 0.83 KDM4E (0.39) KDM4EALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL5510647 0.83 KDM4E (0.38) KDM4EALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL5249126 0.79 KDM4E (0.39) KDM4EALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL5253124 0.78 KDM4E (0.39) KDM4EALDH1A1MAPTSMN1; SMN2TP53
SCHEMBL31172421 0.78 NPC1 (0.44) NPC1
SCHEMBL3536514 0.77 DRD3 (0.44) KDM4EALDH1A1TP53NPC1RAB9A
SCHEMBL31172384 0.77 NPC1 (0.42) KDM4EMAPTNPC1

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 9 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-7232912-B2 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation AGOURON PHARMACEUTICALS, INC. (US) 2007-06-19 US disclosed
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 KDM4E 2501/4885ALDH1A1 1759/4885MAPT 902/4885
US-20020161022-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 KDM4E 2501/4885ALDH1A1 1759/4885MAPT 902/4885
US-20030139463-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation CDK3, MKI67, ROCK1 KDM4E 2501/4885ALDH1A1 1759/4885MAPT 902/4885
US-20060111322-A1 Indazole compounds, pharmaceutical compositions, and methods for mediating or inhibiting cell proliferation MKI67, CCNI, CDK3 KDM4E 2084/4885ALDH1A1 1201/4885MAPT 2542/4885

“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.