SCHEMBL913596

SCHEMBL913596

NC(=O)c1cnc(Nc2ccc(Cl)c(NC(=O)N3CCCCC3)c2)nc1NCc1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
STAT6 P42226 16/20 0.65
SYK P43405 1/20 0.57
NTRK1 P04629 2/20 0.51
NUAK1 O60285 1/20 0.51
STK16 O75716 1/20 0.51
CSNK2A2 P19784 1/20 0.51
TYK2 P29597 1/20 0.51
BMPR2 Q13873 1/20 0.51
AAK1 Q2M2I8 1/20 0.51
NUAK2 Q9H093 1/20 0.51
MKNK2 Q9HBH9 1/20 0.51
BMP2K Q9NSY1 1/20 0.51
TBK1 Q9UHD2 1/20 0.51
JAK2 O60674 1/20 0.49
JAK1 P23458 1/20 0.49
JAK3 P52333 1/20 0.49

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
SCHEMBL913780 0.99 STAT6 (0.65) STAT6SYKNTRK1NUAK1STK16
SCHEMBL912999 0.98 STAT6 (0.62) STAT6SYKNTRK1NUAK1STK16
SCHEMBL913126 0.92 STAT6 (0.64) STAT6SYKNTRK1NUAK1STK16
SCHEMBL913575 0.92 STAT6 (0.67) STAT6SYK
SCHEMBL3723332 0.92 STAT6 (0.55) STAT6SYKJAK2JAK1JAK3
SCHEMBL3718768 0.91 JAK3 (0.55) STAT6SYKJAK2JAK1JAK3
SCHEMBL913654 0.91 STAT6 (0.62) STAT6NTRK1JAK2JAK1JAK3
SCHEMBL913754 0.89 STAT6 (0.69) STAT6SYKNTRK1NUAK1STK16
SCHEMBL913678 0.88 STAT6 (0.60) STAT6JAK2JAK1JAK3
SCHEMBL913742 0.88 STAT6 (0.65) STAT6SYKNTRK1JAK2JAK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 US claimed
US-20110005947-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2011-01-13 US claimed
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 US disclosed
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 US disclosed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 US disclosed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 US disclosed
US-8367689-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-8367689-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-02-05 US disclosed
US-20110005947-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2011-01-13 US disclosed
US-20110005947-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2011-01-13 US disclosed
WO-2010129802-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2010-11-11 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-20130137673-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 STAT6 16/4885SYK 72/4885NTRK1 3318/4885
US-20110005947-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 STAT6 16/4885SYK 72/4885NTRK1 3318/4885

“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.