SCHEMBL4427686

SCHEMBL4427686

C=CCOC(=O)C(CCBr)NC(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.55
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
HTT P42858 1/20 0.41
CTSK P43235 14/20 0.39
CTSS P25774 6/20 0.39
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
MAPT P10636 2/20 0.37
ALDH1A1 P00352 1/20 0.37
CTSL P07711 1/20 0.36
CTSB P07858 1/20 0.36

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
SCHEMBL7690020 0.91 SMN1; SMN2 (0.52) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL7765475 0.91 SMN1; SMN2 (0.52) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL701700 0.89 SMN1; SMN2 (0.57) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL4371611 0.89 SMN1; SMN2 (0.57) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL6722519 0.87 SMN1; SMN2 (0.56) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL6719127 0.87 SMN1; SMN2 (0.56) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL6722516 0.87 SMN1; SMN2 (0.56) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL27429586 0.86 SMN1; SMN2 (0.55) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL28160693 0.86 SMN1; SMN2 (0.55) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT
SCHEMBL17232237 0.85 SMN1; SMN2 (0.57) SMN1; SMN2CYP1A2CYP2C9CYP2C19HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7517855-B2 Peptides which inhibit angiogenesis, cell migration, cell invasion and cell proliferation, compositions and uses thereof ATTENUON, LLC (US) 2009-04-14 US disclosed
EP-1594521-A4 PEPTIDES WHICH INHIBIT ANGIOGENESIS, CELL MIGRATION, CELL INVASION AND CELL PROLIFERATION, COMPOSITIONS AND USES THEREOF ATTENUON LLC (US) 2008-01-09 EP disclosed
EP-1594521-A2 PEPTIDES WHICH INHIBIT ANGIOGENESIS, CELL MIGRATION, CELL INVASION AND CELL PROLIFERATION, COMPOSITIONS AND USES THEREOF Attenuon, LLC (US) 2005-11-16 EP disclosed
US-20040162239-A1 Peptides which inhibit angiogenesis, cell migration, cell invasion and cell proliferation, compositions and uses thereof ATTENUON LLC 2004-08-19 US disclosed
WO-2004047771-A2 PEPTIDES WHICH INHIBIT ANGIOGENESIS, CELL MIGRATION, CELL INVASION AND CELL PROLIFERATION, COMPOSITIONS AND USES THEREOF ATTENUON, LLC. (US) 2004-06-10 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-20040162239-A1 Peptides which inhibit angiogenesis, cell migration, cell invasion and cell proliferation, compositions and uses thereof HDGF, VIP, PGF SMN1; SMN2 4508/4885CYP1A2 4839/4885CYP2C9 4577/4885

“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.