SCHEMBL1957358

SCHEMBL1957358

COC(=O)c1ccc(N2CCN(Cc3ccccc3-c3ccc(Cl)cc3)CC2)cc1OC.COc1c(C(=O)O)ccc(Br)c1C

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR7 P34969 3/20 0.53
▸ BCL2 P10415 6/20 0.51
▸ BCL2L1 Q07817 4/20 0.51
▸ BAK1 Q16611 2/20 0.48
▸ DRD3 P35462 2/20 0.46
▸ DRD2 P14416 1/20 0.46
▸ DRD4 P21917 1/20 0.46
▸ HRH2 P25021 1/20 0.46
▸ HRH1 P35367 1/20 0.46

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
SCHEMBL1743551 0.89 HTR7 (0.63) HTR7BCL2BCL2L1BAK1DRD3
SCHEMBL1743533 0.87 HTR7 (0.66) HTR7BCL2BCL2L1BAK1DRD3
SCHEMBL1958974 0.84 BCL2 (0.58) HTR7BCL2BCL2L1BAK1
SCHEMBL1742388 0.82 BCL2 (0.65) BCL2BCL2L1
SCHEMBL1960149 0.82 BCL2 (0.58) HTR7BCL2BCL2L1BAK1
SCHEMBL1959679 0.81 HTR7 (0.58) HTR7BCL2BCL2L1BAK1
SCHEMBL1955301 0.81 BCL2 (0.62) BCL2BCL2L1BAK1
SCHEMBL1741545 0.81 HTR7 (0.55) HTR7BCL2BCL2L1BAK1
SCHEMBL2826626 0.80 BCL2 (0.60) HTR7BCL2BCL2L1BAK1
SCHEMBL1957222 0.80 BCL2 (0.53) HTR7BCL2BCL2L1BAK1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2507229-A1 SULFONAMIDE DERIVATIVES AS BCL-2-SELECTIVE APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE DISEASES Abbott Laboratories (US) 2012-10-10 — — EP disclosed
WO-2011068561-A1 SULFONAMIDE DERIVATIVES AS BCL-2-SELECTIVE APOPTOSIS-INDUCING AGENTS FOR THE TREATMENT OF CANCER AND IMMUNE DISEASES ABBOTT LABORATORIES (US) 2011-06-09 — — WO disclosed
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