SCHEMBL2367260

SCHEMBL2367260

COc1ccc(Oc2ccc3c4c(cccc24)C2=NC(=O)C(C#N)=C23)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ MCL1 Q07820 20/20 1.00
▸ BCL2 P10415 13/20 1.00
▸ BCL2L1 Q07817 4/20 0.80
▸ FGFR1 P11362 1/20 0.55

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
SCHEMBL2367188 0.92 MCL1 (1.00) MCL1BCL2BCL2L1FGFR1
SCHEMBL2368171 0.92 MCL1 (1.00) MCL1BCL2BCL2L1FGFR1
SCHEMBL2367447 0.90 MCL1 (0.88) MCL1BCL2BCL2L1FGFR1
SCHEMBL2367939 0.90 MCL1 (0.88) MCL1BCL2BCL2L1FGFR1
SCHEMBL2367349 0.89 MCL1 (1.00) MCL1BCL2BCL2L1FGFR1
SCHEMBL14935309 0.89 MCL1 (1.00) MCL1BCL2BCL2L1FGFR1
SCHEMBL14935359 0.86 MCL1 (0.78) MCL1BCL2BCL2L1FGFR1
SCHEMBL29523513 0.86 MCL1 (0.78) MCL1BCL2BCL2L1FGFR1
SCHEMBL14935245 0.86 MCL1 (0.78) MCL1BCL2BCL2L1FGFR1
SCHEMBL14935611 0.85 MCL1 (1.00) MCL1BCL2BCL2L1FGFR1

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-2366701-A1 ACENAPHTHO HETEROCYCLE COMPOUNDS, CYCLODEXTRIN INCLUSION COMPOUNDS AND COMPLEXES, AND USES IN THE MANUFACTURES OF BH3 PROTEIN ANALOGUE, BCL-2 FAMILY PROTEIN INHIBITORS THEREOF Dalian University Of Technology (CN) 2011-09-21 — — EP disclosed
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