SCHEMBL24619785

SCHEMBL24619785

O=Nc1cc(SNC(=O)c2ccc(N3CCN(Cc4ccccc4-c4cncc(C(=O)O)c4)CC3)cc2)ccc1NCCSc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ BCL2L1 Q07817 17/20 0.41
▸ BCL2 P10415 11/20 0.41
▸ BAK1 Q16611 2/20 0.38
▸ BAD Q92934 1/20 0.37

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
SCHEMBL26846619 0.89 BCL2L1 (0.41) BCL2L1BCL2BAK1BAD
SCHEMBL26846618 0.83 BCL2L1 (0.41) BCL2L1BCL2BAD
SCHEMBL24619782 0.80 BCL2L1 (0.40) BCL2L1BCL2BAK1
SCHEMBL26844962 0.79 BCL2L1 (0.47) BCL2L1BCL2BAK1BAD
SCHEMBL26680320 0.79 BCL2L1 (0.66) BCL2L1BCL2BAK1BAD
SCHEMBL26845152 0.77 BCL2 (0.48) BCL2L1BCL2BAK1BAD
SCHEMBL26845031 0.77 BCL2L1 (0.44) BCL2L1BCL2BAK1BAD
SCHEMBL21896468 0.76 BCL2L1 (0.59) BCL2L1BCL2BAK1BAD
SCHEMBL26680309 0.75 BCL2L1 (0.48) BCL2L1BCL2BAK1BAD
SCHEMBL26844943 0.75 BCL2L1 (0.45) BCL2L1BCL2

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
WO-2022149618-A1 METHOD FOR ALKYLATING ACIDIC FUNCTIONAL GROUP 中外製薬株式会社 2022-07-14 — — WO disclosed
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