SCHEMBL28057897

SCHEMBL28057897

[CH2]C(CN)n1ccnc1

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
SCHEMBL28147170 0.78 — —
SCHEMBL28786642 0.77 CYP19A1 (0.41) —
SCHEMBL28077427 0.74 — —
SCHEMBL18546634 0.74 — —
SCHEMBL28023189 0.74 CYP19A1 (0.45) —
SCHEMBL7737006 0.74 CYP17A1 (0.39) —
SCHEMBL7919749 0.72 CYP17A1 (0.49) —
SCHEMBL2990565 0.72 — —
SCHEMBL7731124 0.71 CYP19A1 (0.46) —
SCHEMBL28286874 0.71 CYP17A1 (0.41) —

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
CN-105386008-A Method for forming metal film FLOSFIA INC 2016-03-09 — — CN disclosed
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