SCHEMBL912979

SCHEMBL912979

CC(Nc1nc(Nc2cccc(N(C)C(=O)N3CCCC3)c2)ncc1C(N)=O)c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SYK P43405 14/20 0.59
MAPK8 P45983 1/20 0.45
MAPK9 P45984 1/20 0.45
EGFR P00533 1/20 0.45
STAT6 P42226 1/20 0.44
MAP4K3 Q8IVH8 1/20 0.43
MAP4K1 Q92918 1/20 0.43
IRAK4 Q9NWZ3 1/20 0.43
JAK3 P52333 2/20 0.43
JAK2 O60674 1/20 0.43
JAK1 P23458 1/20 0.43

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
SCHEMBL912978 1.00 SYK (0.59) SYKMAPK8MAPK9EGFRSTAT6
SCHEMBL912892 0.88 SYK (0.58) SYKMAPK8MAPK9EGFRMAP4K3
SCHEMBL912893 0.88 SYK (0.58) SYKMAPK8MAPK9EGFRMAP4K3
SCHEMBL913767 0.86 SYK (0.62) SYKMAPK8MAPK9EGFR
SCHEMBL913769 0.86 SYK (0.62) SYKMAPK8MAPK9EGFR
SCHEMBL913191 0.85 STAT6 (0.62) SYKSTAT6JAK3JAK2JAK1
SCHEMBL912948 0.85 SYK (0.61) SYKMAPK8MAPK9EGFRSTAT6
SCHEMBL912945 0.85 SYK (0.61) SYKMAPK8MAPK9EGFRSTAT6
SCHEMBL913947 0.84 SYK (0.53) SYKMAPK8MAPK9EGFRMAP4K3
SCHEMBL913945 0.84 SYK (0.53) SYKMAPK8MAPK9EGFRMAP4K3

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 72/4885MAPK8 196/4885MAPK9 137/4885
US-20110005947-A1 INHIBITORS OF JAK JAK1, JAK2, JAK3 SYK 72/4885MAPK8 196/4885MAPK9 137/4885

“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.