SCHEMBL2532492

SCHEMBL2532492

O=C(O)c1cc(Cl)c2nc(-n3cccn3)nc(N3CCOCC3)c2n1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 10/20 0.57
HTT P42858 2/20 0.50
LMNA P02545 1/20 0.50
MTOR P42345 1/20 0.43
JAK3 P52333 1/20 0.43
NTRK2 Q16620 1/20 0.43
CAMK2A Q9UQM7 1/20 0.43
EGLN1 Q9GZT9 5/20 0.41
ADORA2A P29274 3/20 0.41
SMN1; SMN2 Q16637 1/20 0.39
PIK3R1 P27986 1/20 0.38

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
SCHEMBL2533823 0.88 HTT (0.46) PIK3CAHTTLMNAMTORJAK3
SCHEMBL2534623 0.82 PIK3CA (0.54) PIK3CAEGLN1SMN1; SMN2PIK3R1
SCHEMBL2530453 0.81 LMNA (0.52) PIK3CAHTTLMNAMTORJAK3
SCHEMBL2536573 0.77 HTT (0.46) PIK3CAHTTLMNAMTORJAK3
SCHEMBL18394361 0.73 HTT (0.54) PIK3CAHTTLMNAMTORJAK3
SCHEMBL13257323 0.72 PIK3CA (1.00) PIK3CA
SCHEMBL2534701 0.72 LMNA (0.48) PIK3CAHTTLMNAMTORJAK3
SCHEMBL2537279 0.71 PIK3CA (0.43) PIK3CAHTTMTOR
SCHEMBL13258331 0.69 PIK3CA (0.77) PIK3CA
SCHEMBL13258255 0.69 PIK3CA (0.77) PIK3CA

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-20110257170-A1 4-MORPHOLINO-PYRIDO[3,2-D]PYRIMIDINES MERCK SERONO SA (CH) 2011-10-20 US disclosed
US-20110257170-A1 4-MORPHOLINO-PYRIDO[3,2-D]PYRIMIDINES MERCK SERONO SA (CH) 2011-10-20 US disclosed
US-20110257170-A1 4-MORPHOLINO-PYRIDO[3,2-D]PYRIMIDINES MERCK SERONO SA (CH) 2011-10-20 US disclosed
WO-2010037765-A2 4-MORPHOLINO-PYRIDO[3,2-D]PYRIMIDINES MERCK SERONO S.A. (CH) 2010-04-08 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-20110257170-A1 4-MORPHOLINO-PYRIDO[3,2-D]PYRIMIDINES PIK3CA, PIK3CD, PIK3CG PIK3CA 1/4885HTT 3933/4885LMNA 4183/4885

“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.