SCHEMBL9424476

SCHEMBL9424476

CCCCC(=CC(=O)O)c1cnc(CCCC)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
SCHEMBL9424473 1.00 — —
SCHEMBL9424469 1.00 — —
SCHEMBL9424428 0.93 — —
SCHEMBL9424545 0.90 — —
SCHEMBL9424555 0.90 — —
SCHEMBL9424550 0.90 — —
Hydrochloric Acid SCHEMBL9424335 0.89 — —
Hydrochloric Acid SCHEMBL9424340 0.89 — —
Hydrochloric Acid SCHEMBL9424331 0.89 — —
SCHEMBL27407333 0.89 — —

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
US-5312828-A Substituted imidazoles having angiotensin II receptor blocking activity SMITHKLINE BEECHAM CORPORATION A CORP. OF PENNSYLVANIA 1994-05-17 — — US disclosed
EP-0403158-A2 Imidazolyl-alkenoic acids SMITHKLINE BEECHAM CORPORATION (US) 1990-12-19 — — EP disclosed
Send feedback