SCHEMBL2387166

SCHEMBL2387166

CN(C)CCNC(=O)c1cccc(-c2cnc(N)c(-c3nc4cccnc4o3)c2)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKD3 O94806 1/20 0.60
PRKD1 Q15139 1/20 0.60
PRKD2 Q9BZL6 1/20 0.60
GRK5 P34947 2/20 0.55
FYN P06241 7/20 0.53
MAP4K4 O95819 2/20 0.51
TP53 P04637 1/20 0.47
CDK1 P06493 1/20 0.43
CDK2 P24941 1/20 0.43
MKNK1 Q9BUB5 1/20 0.43
MKNK2 Q9HBH9 1/20 0.43
CAMK2D Q13557 2/20 0.42
CHEK2 O96017 1/20 0.42
RAD52 P43351 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL2386088 0.92 GRK5 (0.54) PRKD3PRKD1PRKD2GRK5FYN
SCHEMBL2384953 0.92 PRKD3 (0.51) PRKD3PRKD1PRKD2GRK5FYN
SCHEMBL2386229 0.88 PRKD3 (0.62) PRKD3PRKD1PRKD2GRK5FYN
SCHEMBL2387896 0.87 L3MBTL1 (0.52) PRKD3PRKD1PRKD2GRK5FYN
SCHEMBL2387050 0.86 PRKD3 (0.59) PRKD3PRKD1PRKD2GRK5FYN
SCHEMBL2384991 0.85 GRK5 (0.68) PRKD3PRKD1PRKD2GRK5FYN
SCHEMBL2386322 0.83 GRK5 (0.78) GRK5FYNMAP4K4CAMK2DCYP1A2
SCHEMBL2387884 0.83 GRK5 (0.52) GRK5FYNMAP4K4
SCHEMBL1679724 0.83 PRKD3 (0.61) PRKD3PRKD1PRKD2GRK5FYN
SCHEMBL1679470 0.82 PRKD3 (0.65) PRKD3PRKD1PRKD2GRK5FYN

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-8017611-B2 Pyridine and pyrazine derivatives -083 ASTRAZENECA AB (SE) 2011-09-13 US disclosed
EP-2215085-B1 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2011-09-07 EP disclosed
EP-2215085-A2 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS AstraZeneca AB (SE) 2010-08-11 EP disclosed
US-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 ASTRAZENECA AB (SE) 2009-05-07 US disclosed
WO-2009053737-A2 PYRIDINE AND PYRAZINE DERIVATIVES USEFUL IN THE TREATMENT OF CELL PROLIFERATIVE DISORDERS ASTRAZENECA AB (SE) 2009-04-30 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 (1 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-20090118305-A1 PYRIDINE AND PYRAZINE DERIVATIVES - 083 MKI67, CCND3, CCND1 PRKD3 33/4885PRKD1 98/4885PRKD2 136/4885

“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.