SCHEMBL754936

SCHEMBL754936

COC(=O)c1cc(Nc2cc[nH]n2)n(-c2cc(N)nc(C)n2)n1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 3/20 0.32
HPGD P15428 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HSD17B10 Q99714 1/20 0.32
MPO P05164 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
PTGS2 P35354 1/20 0.31
PIK3CA P42336 1/20 0.30
MTOR P42345 1/20 0.30
MAPK10 P53779 1/20 0.30

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
SCHEMBL7888556 0.91 MPO (0.41) L3MBTL1MPOSMN1; SMN2
SCHEMBL755677 0.91 ALDH1A1 (0.31) ALDH1A1PIK3CAMTOR
SCHEMBL7890083 0.85 SPR (0.36) HPGDKDM4EHSD17B10PTGS2
SCHEMBL751161 0.84 TSHR (0.36) ALDH1A1HPGDKDM4EHSD17B10MPO
SCHEMBL754183 0.78 SLC2A1 (0.35) HPGDKDM4EMPO
SCHEMBL754096 0.76 SLC2A1 (0.34) KDM4EMPO
SCHEMBL751760 0.70 ALOX15 (0.39) ALDH1A1HPGDKDM4EHSD17B10SMN1; SMN2
SCHEMBL11028687 0.69 PIK3CA (0.48) HPGDSMN1; SMN2PIK3CAMTOR
SCHEMBL11027419 0.69 PIK3CA (0.40) PIK3CAMTOR
SCHEMBL751607 0.66 PIK3CA (0.37) PIK3CAMTOR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US claimed
US-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors AMGEN INC. (US) 2012-07-26 US disclosed
EP-2430013-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS Amgen, Inc (US) 2012-03-21 EP disclosed
WO-2010132598-A1 HETEROARYL COMPOUNDS AS PIKK INHIBITORS AMGEN INC. (US) 2010-11-18 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-20120190666-A1 Heteroaryl Compounds as PIKK Inhibitors PIK3CA, PIKFYVE, PIK3CD L3MBTL1 4014/4885ALDH1A1 4785/4885HPGD 3556/4885

“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.