SCHEMBL1015487

SCHEMBL1015487

NC(=O)c1ccc(Nc2nc(NC3CCCNC3)c3cc[nH]c3n2)cc1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 3/20 0.59
LRRK2 Q5S007 1/20 0.56
PAK4 O96013 3/20 0.55
BTK Q06187 7/20 0.51
JAK3 P52333 8/20 0.51
SYK P43405 1/20 0.51
NTRK1 P04629 1/20 0.50
CHEK1 O14757 1/20 0.47
IRAK4 Q9NWZ3 1/20 0.47

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
SCHEMBL14547888 0.90 SYK (0.62) LRRK2PAK4BTKJAK3SYK
SCHEMBL14547908 0.89 LRRK2 (0.60) LRRK2PAK4BTKJAK3SYK
SCHEMBL1019550 0.88 PAK4 (0.71) PTK2LRRK2PAK4BTKJAK3
SCHEMBL12085318 0.88 LRRK2 (0.64) LRRK2PAK4BTKJAK3SYK
SCHEMBL12085425 0.81 MERTK (0.66) PTK2LRRK2PAK4BTKJAK3
SCHEMBL14547844 0.80 LRRK2 (0.56) PTK2LRRK2PAK4BTKJAK3
SCHEMBL16764898 0.79 JAK3 (0.62) PTK2PAK4BTKJAK3NTRK1
SCHEMBL16764897 0.79 JAK3 (0.62) PTK2PAK4BTKJAK3NTRK1
SCHEMBL14547954 0.79 PTK2 (0.60) PTK2LRRK2PAK4BTKJAK3
SCHEMBL12085429 0.78 PTK2 (0.64) PTK2PAK4BTKJAK3SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9139581-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2015-09-22 US disclosed
US-9139581-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2015-09-22 US disclosed
US-9139581-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2015-09-22 US disclosed
US-20130029944-A1 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2013-01-31 US disclosed
US-20130029944-A1 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2013-01-31 US disclosed
US-20130029944-A1 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2013-01-31 US disclosed
US-8258144-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-09-04 US disclosed
US-8258144-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-09-04 US disclosed
US-8258144-B2 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2012-09-04 US disclosed
EP-2271631-A2 INHIBITORS OF PROTEIN KINASES Portola Pharmaceuticals, Inc. (US) 2011-01-12 EP disclosed
US-20090298823-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-03 US disclosed
US-20090298823-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-03 US disclosed
US-20090298823-A1 Inhibitors of protein kinases PORTOLA PHARMACEUTICALS, INC. (US) 2009-12-03 US disclosed
WO-2009131687-A2 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2009-10-29 WO disclosed
WO-2009131687-A2 INHIBITORS OF PROTEIN KINASES PORTOLA PHARMACEUTICALS, INC. (US) 2009-10-29 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-20130029944-A1 INHIBITORS OF PROTEIN KINASES SYK, BTK, JAK2 PTK2 17/4885LRRK2 1444/4885PAK4 762/4885
US-20090298823-A1 Inhibitors of protein kinases SYK, BTK, JAK2 PTK2 17/4885LRRK2 1444/4885PAK4 762/4885

“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.