SCHEMBL9989031

SCHEMBL9989031

CNC(=O)Nc1nc(NC(=O)NC)nc(NN2C(=O)CCC2=O)n1

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PIK3R1 P27986 1/20 0.36
PIK3CA P42336 1/20 0.36
MTOR P42345 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.33
KMT2A Q03164 1/20 0.33
ALDH1A1 P00352 1/20 0.32
RECQL P46063 1/20 0.32
GAA P10253 1/20 0.31
JAK1 P23458 1/20 0.31
POLB P06746 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
SCHEMBL9989022 0.93 PIK3R1 (0.35) PIK3R1PIK3CAMTOR
SCHEMBL2478969 0.78 ALDH1A1 (0.46) PIK3R1PIK3CAMTORSMN1; SMN2KMT2A
SCHEMBL19175734 0.70 ALDH1A1 (0.40) PIK3R1PIK3CAMTORSMN1; SMN2KMT2A
SCHEMBL2474178 0.69 POLB (0.60) SMN1; SMN2KMT2AALDH1A1RECQLGAA
SCHEMBL2472999 0.69 ALDH1A1 (0.39) PIK3R1PIK3CAMTORSMN1; SMN2KMT2A
SCHEMBL20457039 0.69 ALDH1A1 (0.39) PIK3R1PIK3CAMTORSMN1; SMN2KMT2A
SCHEMBL2475981 0.67 GAA (0.32) GAA
SCHEMBL19175466 0.66 ALDH1A1 (0.40) PIK3R1PIK3CAMTORSMN1; SMN2KMT2A
SCHEMBL7186156 0.65 ALDH1A1 (0.39) PIK3R1PIK3CAMTORSMN1; SMN2KMT2A
SCHEMBL20063060 0.65 POLB (0.44) PIK3R1PIK3CAMTORSMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110295001-A1 Method for Producing Triazine Carbamates Using Chloroformates BOREALIS AGROLINZ MELAMINE GMBH (AT) 2011-12-01 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-20110295001-A1 Method for Producing Triazine Carbamates Using Chloroformates CA3, CA7, KAT5 PIK3R1 4740/4885PIK3CA 4267/4885MTOR 4825/4885

“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.