SCHEMBL3428779

SCHEMBL3428779

CN1CCN(CCC[O])C[C@H]1CO

nearest known ligand 0.40

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 3/20 0.33
USP2 O75604 1/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
GBA1 P04062 1/20 0.30
TP53 P04637 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL3431766 1.00 SIGMAR1 (0.33) SIGMAR1USP2MEN1KMT2AALDH1A1
SCHEMBL3429437 0.89 MEN1 (0.32) MEN1KMT2A
SCHEMBL3428842 0.89 MEN1 (0.32) MEN1KMT2A
SCHEMBL3428782 0.85 SIGMAR1 (0.38) SIGMAR1MEN1KMT2AALDH1A1L3MBTL1
SCHEMBL3429440 0.81 MAPK1 (0.40) SIGMAR1MEN1KMT2AALDH1A1GBA1
SCHEMBL14438561 0.81 MAPK1 (0.40) SIGMAR1MEN1KMT2AALDH1A1GBA1
SCHEMBL3428847 0.81 MAPK1 (0.40) SIGMAR1MEN1KMT2AALDH1A1GBA1
SCHEMBL3427122 0.78 GRIN2D (0.31)
SCHEMBL24802087 0.77 SIGMAR1 (0.35) SIGMAR1MEN1KMT2AGBA1SMN1; SMN2
SCHEMBL25873415 0.77 SIGMAR1 (0.35) SIGMAR1MEN1KMT2AGBA1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7691867-B2 Chemical compounds ASTRAZENECA AB (SE) 2010-04-06 US disclosed
EP-1613619-B1 QUINAZOLINE DERIVATIVES FOR TREATMENT OF CANCER ASTRAZENECA AB (SE) 2008-03-26 EP disclosed
US-20060270692-A1 Chemical compounds ASTRAZENECA AB (SE) 2006-11-30 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-20060270692-A1 Chemical compounds CCNI, MKI67, TP53 SIGMAR1 3443/4885USP2 4228/4885MEN1 241/4885

“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.