SCHEMBL16392500

SCHEMBL16392500

COC(=O)c1ccc(NC(=O)c2ccc(N)c(OC(C)C)c2O)c(OC(C)C)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EP300 Q09472 2/20 0.52
▸ BCL2 P10415 1/20 0.47
▸ BCL2L1 Q07817 1/20 0.47
▸ MCL1 Q07820 1/20 0.47
▸ BAK1 Q16611 1/20 0.47
▸ TOP2A P11388 5/20 0.45
▸ MAPT P10636 3/20 0.45
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ KDM4E B2RXH2 3/20 0.43
▸ ALDH1A1 P00352 3/20 0.43
▸ GAA P10253 2/20 0.43
▸ GLA P06280 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ CASP1 P29466 1/20 0.43
▸ CASP7 P55210 1/20 0.43
▸ ATM Q13315 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ MAPK1 P28482 1/20 0.43
▸ AR P10275 1/20 0.42

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
SCHEMBL16369610 0.90 EP300 (0.63) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL19608100 0.89 EP300 (0.49) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL16371049 0.89 MAPT (0.48) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL28514795 0.86 EP300 (0.43) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL17775442 0.85 ALDH1A1 (0.47) EP300TOP2AMAPTNPC1RAB9A
SCHEMBL16392534 0.85 EP300 (0.48) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL16392552 0.84 PYGL (0.48) MAPTNPC1RAB9AKDM4EALDH1A1
SCHEMBL19608160 0.84 EP300 (0.50) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL17775434 0.84 EP300 (0.49) EP300BCL2BCL2L1MCL1BAK1
SCHEMBL16392496 0.84 AR (0.58) EP300MAPTKDM4EGAAAR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11225503-B2 Crystobactamides Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2022-01-18 — — US disclosed
EP-3019615-B1 CYSTOBACTAMIDES HELMHOLTZ ZENTRUM INFEKTIONSFORSCHUNG GMBH (DE) 2021-04-07 — — EP disclosed
US-20200331964-A1 CYSTOBACTAMIDES HELMHOLTZ ZENTRUM INFEKTIONSFORSCHUNG GMBH (DE) 2020-10-22 — — US disclosed
US-10793600-B2 Cystobactamides Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2020-10-06 — — US disclosed
US-20190185514-A1 CYSTOBACTAMIDES HELMHOLTZ ZENTRUM INFEKTIONSFORSCHUNG GMBH (DE) 2019-06-20 — — US disclosed
US-20160145304-A1 CYSTOBACTAMIDES HELMHOLTZ-ZENTRUM FUR INFEKTIONSFORSCHUNG GMBH (DE) 2016-05-26 — — US disclosed
US-20160145304-A1 CYSTOBACTAMIDES HELMHOLTZ-ZENTRUM FUR INFEKTIONSFORSCHUNG GMBH (DE) 2016-05-26 — — US disclosed
WO-2015003816-A2 CYSTOBACTAMIDES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2015-01-15 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160145304-A1 CYSTOBACTAMIDES CTH, SLC7A11, CBS EP300 3526/4885BCL2 2186/4885BCL2L1 1794/4885
US-11225503-B2 Crystobactamides PKD2, SLC7A11, CTH EP300 4199/4885BCL2 2103/4885BCL2L1 711/4885
US-20190185514-A1 CYSTOBACTAMIDES CTH, SLC7A11, SULT2A1 EP300 3359/4885BCL2 3703/4885BCL2L1 1668/4885
US-20200331964-A1 CYSTOBACTAMIDES CTH, SLC7A11, SULT2A1 EP300 3416/4885BCL2 3481/4885BCL2L1 1489/4885
US-10793600-B2 Cystobactamides CTH, SLC7A11, SULT2A1 EP300 3514/4885BCL2 3856/4885BCL2L1 1795/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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