SCHEMBL7086397

SCHEMBL7086397

Cc1cccc(-c2cc([C@@H](OCc3ccccc3)c3cncn3C)ccc2C#N)c1C

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
Hydrochloric Acid SCHEMBL7571238 0.99
SCHEMBL7571241 0.94 PGGT1B (0.77)
SCHEMBL7577050 0.94
Hydrochloric Acid SCHEMBL7569489 0.93 PGGT1B (0.76)
Hydrochloric Acid SCHEMBL7568863 0.93
SCHEMBL7569831 0.89
SCHEMBL7571844 0.89
SCHEMBL7087015 0.89
SCHEMBL7087012 0.89
Hydrochloric Acid SCHEMBL7570472 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
EP-1276726-A2 SUBSTITUTED PHENYL FARNESYLTRANSFERASE INHIBITORS Abbott Laboratories (US) 2003-01-22 EP disclosed
WO-2001081316-A2 SUBSTITUTED PHENYL FARNESYLTRANSFERASE INHIBITORS ABBOTT LABORATORIES (US) 2001-11-01 WO disclosed