SCHEMBL30163009

SCHEMBL30163009

COC(=O)c1ncn(CCN(CCO)C(=O)OC(C)(C)C)n1.Cc1nc(C(=O)O)nn1CCN(CCO)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ SSTR4 P31391 1/20 0.33
▸ P2RX3 P56373 1/20 0.32

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
SCHEMBL24841256 0.88 SSTR4 (0.40) SSTR4P2RX3
SCHEMBL30162758 0.77 ADRB3 (0.33) —
SCHEMBL30162985 0.77 SSTR4 (0.41) SSTR4P2RX3
SCHEMBL30162689 0.77 ADRB3 (0.32) —
SCHEMBL30162835 0.77 ADRB3 (0.32) —
SCHEMBL24841241 0.71 KMT2A (0.46) SSTR4P2RX3
SCHEMBL30162850 0.70 ADRB3 (0.33) —
SCHEMBL24842027 0.68 SSTR4 (0.38) SSTR4P2RX3
SCHEMBL30162686 0.68 KMT2A (0.37) SSTR4P2RX3
SCHEMBL15199612 0.68 ADRB3 (0.44) —

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
WO-2023277517-A1 ACYCLIC NUCLEIC ACID MIMIC COMPRISING PENTACYCLIC BASE 동아대학교 산학협력단 2023-01-05 — — WO claimed
WO-2023277517-A1 ACYCLIC NUCLEIC ACID MIMIC COMPRISING PENTACYCLIC BASE 동아대학교 산학협력단 2023-01-05 — — WO disclosed
Send feedback