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Sugi Predict / Compounds / SCHEMBL253035

SCHEMBL253035

SCHEMBL253035

CCc1cc(C(=O)N(Cc2ccc(F)cc2)Cc2cc(Cl)cc(Cl)c2)ccc1N(Cc1cccc(-c2ccc(Cl)cc2)c1)S(=O)(=O)c1cc(Cl)cc(Cl)c1O

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ BCL2 P10415 1/20 0.59
▸ ACLY P53396 10/20 0.47
▸ SLC2A1 P11166 1/20 0.39
▸ MEN1 O00255 3/20 0.37
▸ KMT2A Q03164 3/20 0.37
▸ POLB P06746 1/20 0.37
▸ EGFR P00533 1/20 0.36
▸ ERBB2 P04626 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ NR1H4 Q96RI1 1/20 0.36
▸ AOC3 Q16853 2/20 0.35

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
SCHEMBL15157614 0.86 BCL2 (0.80) BCL2ACLYSLC2A1MEN1KMT2A
SCHEMBL184447 0.81 BCL2 (0.61) BCL2ACLYMEN1KMT2APOLB
SCHEMBL184913 0.79 BCL2 (0.80) BCL2ACLYMEN1KMT2APOLB
SCHEMBL185121 0.78 BCL2 (0.85) BCL2ACLYSLC2A1EGFRERBB2
SCHEMBL184499 0.77 ACLY (0.78) BCL2ACLY
SCHEMBL184600 0.76 BCL2 (1.00) BCL2ACLYEGFRERBB2LMNA
SCHEMBL185430 0.74 BCL2 (0.66) BCL2ACLYEGFRERBB2LMNA
SCHEMBL184568 0.73 ACLY (0.69) BCL2ACLY
SCHEMBL184838 0.73 BCL2 (0.81) BCL2ACLYEGFRERBB2ALDH1A1
SCHEMBL185275 0.72 ACLY (0.70) BCL2ACLY

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-2297103-B1 HYDROXYPHENYLSULFONAMIDES AS ANTIAPOPTOTIC BCL INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2012-01-04 — — EP disclosed