SCHEMBL17795709

SCHEMBL17795709

CC(C)Oc1cc(C(=O)O)ccc1NC(=O)c1ccc2c(c1)OC(C)N2C(=O)c1ccc(N)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 3/20 0.51
▸ BCL2 P10415 1/20 0.49
▸ BCL2L1 Q07817 1/20 0.49
▸ MCL1 Q07820 1/20 0.49
▸ BAK1 Q16611 1/20 0.49
▸ HIF1A Q16665 1/20 0.44
▸ HDAC1 Q13547 1/20 0.38
▸ HDAC8 Q9BY41 1/20 0.38
▸ HDAC6 Q9UBN7 1/20 0.38
▸ TOP2A P11388 5/20 0.37
▸ MYC P01106 2/20 0.37
▸ MAX P61244 2/20 0.37
▸ CCR5 P51681 1/20 0.37
▸ BRD4 O60885 2/20 0.37
▸ BRPF1 P55201 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
SCHEMBL17775429 0.81 EP300 (0.69) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL21137831 0.79 EP300 (0.64) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL24089198 0.74 EP300 (0.81) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL17784957 0.72 EP300 (0.58) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL16392526 0.71 MEN1 (0.58) EP300
SCHEMBL16392473 0.70 BCL2 (0.83) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL16392498 0.70 EP300 (0.55) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL16392535 0.70 EP300 (0.55) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL17784958 0.70 EP300 (0.55) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL16392463 0.70 EP300 (0.57) EP300BCL2BCL2L1MCL1BAK1

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-2016082934-A1 NOVEL CYSTOBACTAMIDES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2016-06-02 — — WO disclosed
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