SCHEMBL17044339

SCHEMBL17044339

O=C(O)Oc1[nH]c2ccc(Br)cc2c1CCCOc1cccc2ccccc12

nearest known ligand 0.57

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 20/20 0.57
BCL2 P10415 5/20 0.57
ALB P02768 1/20 0.57
BCL2L1 Q07817 4/20 0.51
BAD Q92934 3/20 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
SCHEMBL17044385 0.97 MCL1 (0.53) MCL1BCL2ALBBCL2L1BAD
SCHEMBL17044347 0.88 MCL1 (0.71) MCL1BCL2ALBBCL2L1BAD
SCHEMBL17044340 0.87 MCL1 (0.56) MCL1BCL2ALBBCL2L1BAD
SCHEMBL17044370 0.86 MCL1 (0.55) MCL1BCL2ALBBCL2L1BAD
SCHEMBL2203925 0.86 MCL1 (0.78) MCL1BCL2ALBBCL2L1
SCHEMBL17044364 0.85 MCL1 (0.54) MCL1BCL2ALBBCL2L1BAD
SCHEMBL2208914 0.83 MCL1 (0.73) MCL1BCL2ALBBCL2L1
SCHEMBL17044305 0.82 MCL1 (0.53) MCL1BCL2ALBBCL2L1BAD
SCHEMBL17044356 0.82 MCL1 (0.58) MCL1BCL2ALBBCL2L1BAD
SCHEMBL2203033 0.80 MCL1 (0.61) MCL1BCL2ALBBCL2L1

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