SCHEMBL17044260

SCHEMBL17044260

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

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 20/20 0.56
BCL2 P10415 3/20 0.53
BCL2L1 Q07817 1/20 0.47

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
SCHEMBL2205705 0.84 MCL1 (0.78) MCL1BCL2BCL2L1
SCHEMBL17044252 0.84 MCL1 (0.74) MCL1BCL2
SCHEMBL17044286 0.80 MCL1 (0.74) MCL1BCL2
SCHEMBL2207465 0.79 MCL1 (0.62) MCL1BCL2
SCHEMBL17044347 0.79 MCL1 (0.71) MCL1BCL2BCL2L1
SCHEMBL19178723 0.76 MCL1 (0.56) MCL1BCL2
SCHEMBL17044250 0.75 MCL1 (0.54) MCL1BCL2BCL2L1
SCHEMBL17044346 0.74 MCL1 (0.50) MCL1BCL2
SCHEMBL17044375 0.74 MCL1 (0.54) MCL1BCL2
SCHEMBL17044294 0.73 MCL1 (0.75) MCL1BCL2BCL2L1

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