SCHEMBL9424406

SCHEMBL9424406

CCCCc1ncc(C(O)C(C)(Cc2ccc3c(c2)OCO3)C(=O)O)n1Cc1ccccc1Cl

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL9490957 0.85 — —
SCHEMBL9424195 0.78 — —
SCHEMBL7052812 0.77 — —
SCHEMBL7052807 0.77 — —
SCHEMBL9511004 0.77 AGTR1 (0.63) —
SCHEMBL9490011 0.76 — —
SCHEMBL7277636 0.73 — —
SCHEMBL9207265 0.73 — —
SCHEMBL8536231 0.72 — —
SCHEMBL8954217 0.71 — —

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-5312828-A Substituted imidazoles having angiotensin II receptor blocking activity SMITHKLINE BEECHAM CORPORATION A CORP. OF PENNSYLVANIA 1994-05-17 — — US disclosed
Send feedback