SCHEMBL2370405

SCHEMBL2370405

COC(=O)[C@@H]1CC[C@H](N(C(=O)O)C(C)(C)C)C1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.36
CHRNB2 P17787 2/20 0.35
CHRNA4 P43681 2/20 0.35
CHRNB4 P30926 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA7 P36544 1/20 0.35
TP53 P04637 1/20 0.33
PPM1B O75688 1/20 0.30
PTPN1 P18031 1/20 0.30
PPP1CC P36873 1/20 0.30
ALDH1A1 P00352 2/20 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
SCHEMBL2371532 0.80 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL12540388 0.80 SMN1; SMN2 (0.30) SMN1; SMN2
SCHEMBL12540848 0.77
SCHEMBL12814494 0.77
SCHEMBL527479 0.76 DPP4 (0.30)
SCHEMBL22405892 0.76
SCHEMBL20108084 0.75 CHRNB2 (0.41) SMN1; SMN2CHRNB2CHRNA4CHRNB4CHRNA3
SCHEMBL12540660 0.75 CTH (0.36) SMN1; SMN2
SCHEMBL12540658 0.75 CTH (0.36) SMN1; SMN2
SCHEMBL2146078 0.74

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-20150272947-A1 INHIBITORS OF PROTEIN KINASES ASTRAZENECA AB (SE) 2015-10-01 US disclosed
US-20110224225-A1 Inhibitors of protein kinases ASTRAZENECA AB (SE) 2011-09-15 US disclosed
WO-2011110612-A1 INHIBITORS OF PROTEIN KINASES INGENIUM PHARMACEUTICALS GMBH (DE) 2011-09-15 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 (2 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-20150272947-A1 INHIBITORS OF PROTEIN KINASES CDK1, CDK2, CDK3 SMN1; SMN2 2779/4885CHRNB2 3357/4885CHRNA4 3572/4885
US-20110224225-A1 Inhibitors of protein kinases CDK1, CDK2, CDK3 SMN1; SMN2 2779/4885CHRNB2 3357/4885CHRNA4 3572/4885

“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.