SCHEMBL5059632

SCHEMBL5059632

COC(=O)c1cc(N2CCOCC2)ccc1O[Si](C)(C)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
RXFP1 Q9HBX9 1/20 0.47
ALDH1A1 P00352 5/20 0.45
PKM P14618 1/20 0.45
HIF1A Q16665 2/20 0.44
PRKDC P78527 1/20 0.44
PTK2 Q05397 3/20 0.43
KDM4E B2RXH2 2/20 0.43
HTT P42858 1/20 0.43
POLB P06746 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43
HCRTR1 O43613 1/20 0.43
HPGD P15428 1/20 0.42
ALOX15 P16050 1/20 0.42
MGLL Q99685 1/20 0.42

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
SCHEMBL1644930 0.84 MAPT (0.57) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL26604551 0.80 PRKDC (0.58) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL31390780 0.79 PRKDC (0.51) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL5058325 0.77 PRKDC (0.59) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL12121402 0.77 MAPT (0.55) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL23662583 0.76 MAPT (0.53) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL12316369 0.76 HIF1A (0.62) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL9344830 0.76 LGMN (0.54) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL30263167 0.76 HIF1A (0.62) MAPTMEN1KMT2ANPC1RAB9A
SCHEMBL1318286 0.75 LRRK2 (0.64) MAPTMEN1KMT2ANPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8242115-B2 Inhibit DNA-dependent protein kinase; reduced side effects caused by radiation and chemotherapy drugs LUITPOLD PHARMACEUTICALS, INC. (US) 2012-08-14 US disclosed
US-20080090782-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. (US) 2008-04-17 US disclosed
US-7179912-B2 Materials and methods to potentiate cancer treatment ICOS CORPORATION (US) 2007-02-20 US disclosed
EP-1351946-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2003-10-15 EP disclosed
US-20020165218-A1 Materials and methods to potentiate cancer treatment LUITPOLD PHARMACEUTICALS, INC. 2002-11-07 US disclosed
WO-2002020500-A2 MATERIALS AND METHODS TO POTENTIATE CANCER TREATMENT ICOS CORPORATION (US) 2002-03-14 WO 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 (2 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-20080090782-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 MAPT 4502/4885MEN1 2946/4885KMT2A 1686/4885
US-20020165218-A1 Materials and methods to potentiate cancer treatment DCK, CHEK2, CHEK1 MAPT 4502/4885MEN1 2946/4885KMT2A 1686/4885

“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.