SCHEMBL30679060

SCHEMBL30679060

CCOC(=O)c1[nH]c2cc(Cl)ccc2c1CCCOc1cccc2ccccc12

nearest known ligand 0.79

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 17/20 0.79
BCL2 P10415 3/20 0.79
BCL2L1 Q07817 2/20 0.79
ALB P02768 1/20 0.60
BAD Q92934 1/20 0.54
ALOX15 P16050 2/20 0.53

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
SCHEMBL15622240 0.92 MCL1 (0.71) MCL1BCL2BCL2L1ALBBAD
SCHEMBL22436900 0.92 MCL1 (0.66) MCL1BCL2BCL2L1ALBALOX15
SCHEMBL15622375 0.90 MCL1 (0.70) MCL1BCL2BCL2L1ALB
SCHEMBL2202505 0.89 MCL1 (0.76) MCL1BCL2BCL2L1ALB
SCHEMBL30679056 0.89 MCL1 (0.76) MCL1BCL2BCL2L1ALB
SCHEMBL15622456 0.89 MCL1 (0.71) MCL1BCL2BCL2L1ALOX15
SCHEMBL2204455 0.89 MCL1 (0.71) MCL1BCL2BCL2L1ALB
SCHEMBL29928296 0.88 MCL1 (1.00) MCL1BCL2BCL2L1ALBBAD
SCHEMBL15622726 0.87 MCL1 (0.71) MCL1BCL2BCL2L1ALOX15
SCHEMBL15622777 0.86 MCL1 (0.73) MCL1BCL2BCL2L1ALB

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-111757884-B Substituted macrocyclic indole derivatives 拜耳股份公司 2023-12-19 CN disclosed