SCHEMBL914698

SCHEMBL914698

CC(=O)Nc1cccc(Nc2ncc(C(N)=O)c(NCC(O)CO)n2)c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SYK P43405 15/20 0.60
EGFR P00533 3/20 0.53
ITK Q08881 1/20 0.51
MAP3K5 Q99683 1/20 0.50
MAPK8 P45983 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
SCHEMBL914696 1.00 SYK (0.60) SYKEGFRITKMAP3K5MAPK8
SCHEMBL913492 0.90 EGFR (0.55) SYKEGFRITKMAP3K5MAPK8
SCHEMBL913493 0.90 EGFR (0.55) SYKEGFRITKMAP3K5MAPK8
SCHEMBL913691 0.89 JAK2 (0.59) SYKEGFRITKMAP3K5MAPK8
SCHEMBL913651 0.87 EGFR (0.56) SYKEGFRITKMAP3K5MAPK8
SCHEMBL913649 0.87 EGFR (0.56) SYKEGFRITKMAP3K5MAPK8
SCHEMBL914810 0.87 EGFR (0.56) SYKEGFRITKMAP3K5MAPK8
SCHEMBL913794 0.86 SYK (0.55) SYKEGFRITKMAP3K5MAPK8
SCHEMBL912928 0.86 EGFR (0.59) SYKEGFRITKMAP3K5MAPK8
SCHEMBL913963 0.85 EGFR (0.58) SYKEGFRITKMAP3K5MAPK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8853230-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2014-10-07 US claimed
US-20130137673-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-05-30 US claimed
US-8367689-B2 Inhibitors of JAK PORTOLA PHARMACEUTICALS, INC. (US) 2013-02-05 US claimed
US-20110005947-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2011-01-13 US claimed
WO-2010129802-A1 INHIBITORS OF JAK PORTOLA PHARMACEUTICALS, INC. (US) 2010-11-11 WO 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 72/4885EGFR 772/4885ITK 433/4885
US-20110005947-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 SYK 72/4885EGFR 772/4885ITK 433/4885

“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.