SCHEMBL29975806

SCHEMBL29975806

CNS(=O)(=O)CCC[S+]([O-])c1nc(-c2ccc(=O)n(Cc3ccc(OC)c(OC)c3)c2)cc(C(F)F)n1

nearest known ligand 0.49

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SDHB P21912 17/20 0.49
▸ TP53 P04637 1/20 0.38
▸ MAPT P10636 1/20 0.38
▸ CREBBP Q92793 2/20 0.34

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
SCHEMBL20985733 1.00 SDHB (0.49) SDHBTP53MAPTCREBBP
SCHEMBL19805982 0.87 SDHB (0.46) SDHBTP53MAPT
SCHEMBL29977013 0.87 SDHB (0.45) SDHBTP53MAPT
SCHEMBL20985645 0.87 SDHB (0.45) SDHBTP53MAPT
SCHEMBL20985719 0.85 SDHB (0.62) SDHBTP53MAPT
SCHEMBL20985681 0.83 SDHB (0.54) SDHBTP53MAPT
SCHEMBL29975895 0.83 SDHB (0.54) SDHBTP53MAPT
SCHEMBL20985704 0.81 SDHB (0.47) SDHBTP53MAPT
SCHEMBL29976232 0.81 SDHB (0.47) SDHBTP53MAPT
SCHEMBL20985656 0.80 SDHB (0.48) SDHBTP53MAPT

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-110023292-B Apoptosis inhibitors 北京生命科学研究所 2022-10-04 — — CN disclosed
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