SCHEMBL3610705

SCHEMBL3610705

CC(C)(C)OC(=O)N1CC[C@@H](N)[C@@H](n2ccnc2)C1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.45
PIK3CD O00329 2/20 0.39
PTPN2 P17706 1/20 0.39
PTPN1 P18031 1/20 0.39
PTPN6 P29350 1/20 0.39
USP30 Q70CQ3 2/20 0.38
HPGD P15428 1/20 0.38

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
SCHEMBL22871669 0.83 GPR119 (0.48) GPR119PIK3CDPTPN2PTPN1PTPN6
SCHEMBL950789 0.80 GPR119 (0.53) GPR119PTPN2PTPN1PTPN6HPGD
SCHEMBL7397405 0.77 GPR119 (0.44) GPR119PTPN2PTPN1PTPN6
SCHEMBL3623892 0.76 GPR119 (0.45) GPR119USP30
SCHEMBL2940507 0.74 HPGD (0.50) GPR119PTPN2PTPN1PTPN6USP30
SCHEMBL20566340 0.74 HPGD (0.50) GPR119PTPN2PTPN1PTPN6USP30
SCHEMBL5646218 0.74 HPGD (0.50) GPR119PTPN2PTPN1PTPN6USP30
SCHEMBL4274742 0.74 HPGD (0.50) GPR119PTPN2PTPN1PTPN6USP30
SCHEMBL12096407 0.74 HPGD (0.50) GPR119PTPN2PTPN1PTPN6USP30
SCHEMBL4121106 0.74 GPR119 (0.43) GPR119PIK3CDPTPN2PTPN1PTPN6

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-20100286181-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY ASTRAZENECA AB (SE) 2010-11-11 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-20100286181-A1 PYRROLE DERIVATIVES WITH ANTIBACTERIAL ACTIVITY PGLS, UROD, GMPS GPR119 4408/4885PIK3CD 786/4885PTPN2 1785/4885

“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.