SCHEMBL15428593

SCHEMBL15428593

Cn1cc(C(N)=O)c(-c2cccc(F)c2)n1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 1/20 0.47
MAP4K4 O95819 1/20 0.45
DCAF1 Q9Y4B6 1/20 0.44
HPGDS O60760 1/20 0.44
CSNK1E P49674 8/20 0.42
CSNK1D P48730 7/20 0.42
PARP1 P09874 1/20 0.41
JAK2 O60674 2/20 0.41
TRPA1 O75762 1/20 0.41
JAK3 P52333 1/20 0.41
GRIN2B Q13224 1/20 0.41
FYN P06241 1/20 0.40
ADCY10 Q96PN6 1/20 0.40

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
SCHEMBL22886635 0.87 KMT2A (0.50) DCAF1TRPA1
SCHEMBL15428638 0.86 DCAF1 (0.54) DCAF1PARP1JAK2
SCHEMBL15750734 0.82 CA12 (0.55) MAP4K4CSNK1ECSNK1D
SCHEMBL26424817 0.82 CA12 (0.53) DCAF1PARP1
SCHEMBL20028187 0.82 JAK2 (0.55) CSNK1DJAK2JAK3
SCHEMBL31457082 0.78 SSTR2 (0.38) DCAF1CSNK1ECSNK1DPARP1
SCHEMBL15428594 0.78 ADCY10 (0.44) MAP4K4CSNK1ECSNK1DADCY10
SCHEMBL31457048 0.76 CSNK1D (0.46) CSNK1ECSNK1DPARP1
SCHEMBL20027495 0.76 DCAF1 (0.53) DCAF1
SCHEMBL21854327 0.76 DCAF1 (0.53) DCAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160244456-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2016-08-25 US disclosed
EP-2962566-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS Genentech, Inc. (US) 2016-01-06 EP disclosed
EP-2348860-B1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH INC (US) 2015-05-27 EP disclosed
US-20140107099-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS GENENTECH, INC. (US) 2014-04-17 US disclosed
US-8637526-B2 Pyrazolopyrimidine JAK inhibitor compounds and methods GENENTECH, INC. (US) 2014-01-28 US 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-20140107099-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 CDC7 341/4885MAP4K4 112/4885DCAF1 808/4885
US-20160244456-A1 PYRAZOLOPYRIMIDINE JAK INHIBITOR COMPOUNDS AND METHODS JAK2, JAK1, JAK3 CDC7 341/4885MAP4K4 112/4885DCAF1 808/4885

“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.