SCHEMBL9973632

SCHEMBL9973632

CC(C)CCNCCNS(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
POLB P06746 1/20 0.32
GRIA1 P42261 3/20 0.31
ALDH1A1 P00352 5/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
HTT P42858 2/20 0.31
CA2 P00918 1/20 0.31
MAPT P10636 1/20 0.31
ALOX15 P16050 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
SCHEMBL2736105 0.86 KMT2A (0.40) KMT2APOLBGRIA1ALDH1A1SMN1; SMN2
SCHEMBL12976429 0.78 LMNA (0.33) KMT2AALDH1A1SMN1; SMN2HTTCA2
SCHEMBL3296405 0.78 LMNA (0.33) KMT2AALDH1A1SMN1; SMN2HTTCA2
SCHEMBL3433536 0.77 GRIA1 (0.43) KMT2APOLBGRIA1ALDH1A1HTT
SCHEMBL469145 0.76 POLB (0.30) KMT2APOLB
SCHEMBL4762362 0.76 GRIA1 (0.46) KMT2APOLBGRIA1ALDH1A1HTT
Methane SCHEMBL4915158 0.75 LMNA (0.32) KMT2AALDH1A1HTTCA2ALOX15
SCHEMBL3043384 0.75 POLB (0.44) POLBALDH1A1HTTCA2MAPT
SCHEMBL40975 0.75 LMNA (0.35) KMT2APOLBALDH1A1SMN1; SMN2HTT
SCHEMBL1235922 0.75 CA1 (0.46) POLBALDH1A1CA2MAPTALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8202879-B2 Quinazoline derivatives having tyrosine kinase inhibitory activity SHIONOGI & CO., LTD. (JP) 2012-06-19 US disclosed
US-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity SHIONOGI & CO., LTD. (JP) 2009-06-04 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-20090143414-A1 Quinazoline Derivatives Having Tyrosine Kinase Inhibitory Activity ERBB2, EGFR, ABL1 KMT2A 1949/4885POLB 3854/4885GRIA1 649/4885

“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.