SCHEMBL12872848

SCHEMBL12872848

BN1CCC(C)C(CO)C1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 1/20 0.31

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
SCHEMBL7990665 0.77 NCF1 (0.37) —
SCHEMBL15691793 0.77 NCF1 (0.37) —
SCHEMBL17464281 0.75 — —
SCHEMBL13286237 0.73 GBA1 (0.38) —
SCHEMBL14071752 0.73 GBA1 (0.38) —
SCHEMBL10226710 0.72 — —
SCHEMBL25530706 0.72 — —
SCHEMBL20289190 0.72 HRH3 (0.31) —
SCHEMBL10226702 0.72 — —
SCHEMBL15929732 0.72 — —

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
WO-2011012540-A1 TRICYCLIC INHIBITORS OF JAK F. HOFFMANN-LA ROCHE AG (CH) 2011-02-03 — — WO disclosed
Send feedback