SCHEMBL913149

SCHEMBL913149

COCC1CCCN1C(=O)Nc1cccc(Nc2ncc(C(N)=O)c(N[C@H](C)c3ccccc3)n2)c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SYK P43405 13/20 0.51
CAMK1D Q8IU85 1/20 0.50
EGFR P00533 3/20 0.45
MAPK8 P45983 1/20 0.44
MAPK9 P45984 1/20 0.44
ITK Q08881 1/20 0.43
MAP4K1 Q92918 1/20 0.42
AURKA O14965 1/20 0.42
RPS6KB1 P23443 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
SCHEMBL913148 1.00 SYK (0.51) SYKCAMK1DEGFRMAPK8MAPK9
SCHEMBL914107 1.00 SYK (0.51) SYKCAMK1DEGFRMAPK8MAPK9
SCHEMBL912973 0.88 SYK (0.55) SYKEGFRMAPK8MAPK9ITK
SCHEMBL912976 0.88 SYK (0.55) SYKEGFRMAPK8MAPK9ITK
SCHEMBL912974 0.88 SYK (0.55) SYKEGFRMAPK8MAPK9ITK
SCHEMBL912274 0.87 STAT6 (0.55) SYKCAMK1D
SCHEMBL912273 0.87 STAT6 (0.55) SYKCAMK1D
SCHEMBL913795 0.87 STAT6 (0.55) SYKCAMK1D
SCHEMBL3809023 0.86 JAK3 (0.52) SYKCAMK1DEGFR
SCHEMBL3716242 0.86 JAK3 (0.52) SYKCAMK1DEGFR

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 7 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-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-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 SYK 72/4885CAMK1D 677/4885EGFR 772/4885
US-20110005947-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 SYK 72/4885CAMK1D 677/4885EGFR 772/4885

“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.