SCHEMBL753598

SCHEMBL753598

Cc1cc(-c2c(Nc3cc[nH]n3)nc3ccc(-c4cccc(S(C)(=O)=O)c4)nn23)nc(C)n1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 5/20 0.43
JAK2 O60674 6/20 0.39
JAK3 P52333 5/20 0.38
PIK3CA P42336 7/20 0.36
MTOR P42345 7/20 0.36
TGFBR1 P36897 1/20 0.35
PTK2 Q05397 3/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL2789279 0.92 PIK3CA (0.43) KCNH2JAK2JAK3PIK3CAMTOR
SCHEMBL751199 0.89 KCNH2 (0.45) KCNH2JAK2JAK3PIK3CAMTOR
SCHEMBL751893 0.78 MTOR (0.47) KCNH2JAK2JAK3PIK3CAMTOR
SCHEMBL11030991 0.77 KCNH2 (0.46) KCNH2JAK2JAK3PIK3CAMTOR
SCHEMBL11026266 0.76 KCNH2 (0.45) KCNH2JAK2JAK3PIK3CAMTOR
SCHEMBL2785811 0.74 PIK3CA (0.48) PIK3CAMTOR
SCHEMBL752822 0.73 FYN (0.45) KCNH2PIK3CAMTORKDM4ESMN1; SMN2
SCHEMBL751467 0.73 PIK3CA (0.45) PIK3CAMTOR
SCHEMBL752419 0.73 MTOR (0.47) PIK3CAMTOR
SCHEMBL2791183 0.73 FYN (0.48) KCNH2JAK2JAK3PIK3CAMTOR

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
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US claimed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP claimed
EP-2430013-B1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC (US) 2014-10-15 EP disclosed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 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 (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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD KCNH2 2938/4885JAK2 312/4885JAK3 442/4885

“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.