SCHEMBL17044252

SCHEMBL17044252

O=C(O)Oc1[nH]c2ccccc2c1CCCOc1cccc(C(F)(F)F)c1

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 19/20 0.74
BCL2 P10415 2/20 0.46

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
SCHEMBL2204311 0.85 MCL1 (1.00) MCL1BCL2
SCHEMBL17044260 0.84 MCL1 (0.56) MCL1BCL2
SCHEMBL2202702 0.80 MCL1 (0.78) MCL1BCL2
SCHEMBL17044286 0.78 MCL1 (0.74) MCL1BCL2
SCHEMBL15623504 0.77 MCL1 (1.00) MCL1
SCHEMBL17044347 0.76 MCL1 (0.71) MCL1BCL2
SCHEMBL22692780 0.75 MCL1 (0.69) MCL1
SCHEMBL15622617 0.73 MCL1 (1.00) MCL1BCL2
SCHEMBL17044250 0.73 MCL1 (0.54) MCL1BCL2
SCHEMBL17044346 0.72 MCL1 (0.50) MCL1BCL2

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
EP-2134685-B1 7-NONSUBSTITUTED INDOLE DERIVATIVES AS MCL-1 INHIBITORS ABBVIE INC (US) 2015-09-02 EP claimed