SCHEMBL1557547

SCHEMBL1557547

c1cc2ncc3[nH]nc(N4CCOCC4)c3c2cc1N1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRKDC P78527 4/20 0.48
▸ FGFR1 P11362 1/20 0.47
▸ FLT1 P17948 1/20 0.47
▸ PIK3CD O00329 1/20 0.45
▸ PIK3CA P42336 1/20 0.45
▸ PIK3CB P42338 1/20 0.45
▸ MAPK10 P53779 1/20 0.43
▸ PDE3B Q13370 1/20 0.43
▸ PDE3A Q14432 1/20 0.43
▸ ITK Q08881 1/20 0.42
▸ LRRK2 Q5S007 2/20 0.42
▸ MAPK1 P28482 2/20 0.42
▸ CLK1 P49759 1/20 0.41
▸ DYRK1A Q13627 1/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ POLB P06746 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL13362122 0.94 PRKDC (0.44) PRKDCFGFR1FLT1PIK3CDPIK3CA
SCHEMBL2396779 0.77 LRRK2 (0.47) PRKDCPIK3CDPIK3CAPIK3CBLRRK2
SCHEMBL1558837 0.76 LRRK2 (0.43) PRKDCFGFR1FLT1PIK3CDPIK3CA
SCHEMBL26912263 0.70 LRRK2 (0.57) FGFR1FLT1MAPK10ITKLRRK2
SCHEMBL1558730 0.69 GAA (0.47) PRKDCKDM4EMEN1ALDH1A1KMT2A
SCHEMBL2395048 0.68 HRH4 (0.55) MAPK1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL8871230 0.68 PIK3CD (0.80) PIK3CDPIK3CAPIK3CB
Hydrochloric Acid SCHEMBL31543151 0.68 MAPK1 (0.49) MAPK1
SCHEMBL18108512 0.67 PIK3CA (0.63) PRKDCPIK3CDPIK3CAPIK3CBPDE3B
SCHEMBL23999520 0.67 MAPKAPK2 (0.54) PRKDCPIK3CDPIK3CAPIK3CBMAPK10

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-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. 2011-09-01 — — US disclosed
US-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. 2011-09-01 — — US disclosed
US-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. 2011-09-01 — — US disclosed
EP-2303890-A2 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS Progenics Pharmaceuticals, Inc. (US) 2011-04-06 — — EP disclosed
WO-2009155527-A9 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2010-05-06 — — WO disclosed
WO-2009155527-A2 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2009-12-23 — — 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 (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-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PIK3CA, AKT1, PIK3R5 PRKDC 137/4885FGFR1 599/4885FLT1 809/4885

“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.

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