SCHEMBL22076724

SCHEMBL22076724

CC(C)Oc1c(NC(=O)c2ccc(NC(=O)C(CC(N)=O)NC(=O)c3ccc(NC(=O)C(C)Oc4ccccc4)cc3)cc2)ccc(C(=O)Nc2ccc(C(=O)O)cc2)c1O

nearest known ligand 0.52

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.52
▸ MEN1 O00255 3/20 0.52
▸ RXFP1 Q9HBX9 1/20 0.52
▸ POLB P06746 1/20 0.48
▸ HPGD P15428 3/20 0.40
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ CRHBP P24387 2/20 0.40
▸ CRHR2 Q13324 2/20 0.40
▸ HTT P42858 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ PLG P00747 1/20 0.38
▸ PLAU P00749 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ TSHR P16473 4/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MDM2 Q00987 1/20 0.36

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
SCHEMBL20764725 1.00 KMT2A (0.52) KMT2AMEN1RXFP1POLBHPGD
SCHEMBL20764481 0.94 MEN1 (0.44) KMT2AMEN1RXFP1POLBALDH1A1
SCHEMBL20764482 0.94 MEN1 (0.44) KMT2AMEN1RXFP1POLBALDH1A1
SCHEMBL20764489 0.91 MEN1 (0.41) KMT2AMEN1RXFP1POLBHPGD
SCHEMBL22076698 0.91 MMP2 (0.38) KMT2AMEN1RXFP1POLBPLG
SCHEMBL22076696 0.91 MMP2 (0.38) KMT2AMEN1RXFP1POLBPLG
SCHEMBL22076692 0.91 PLG (0.40) KMT2AMEN1RXFP1POLBALDH1A1
SCHEMBL20764473 0.90 MEN1 (0.37) KMT2AMEN1RXFP1POLBLMNA
SCHEMBL20764600 0.90 CACNA1B (0.37) KMT2AMEN1RXFP1POLBHTT
SCHEMBL20764599 0.90 CACNA1B (0.37) KMT2AMEN1RXFP1POLBHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11034648-B2 Cystobactamide derivatives HELMHOLTZ-ZENTRUM FÜR (DE) 2021-06-15 — — US disclosed
US-20200190020-A1 NOVEL CYSTOBACTAMIDE DERIVATIVES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2020-06-18 — — US disclosed
CN-110997627-A Novel cystobacter amide derivatives 亥姆霍兹感染研究中心有限公司 2020-04-10 — — CN 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 (2 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-11034648-B2 Cystobactamide derivatives CTH, CBS, SLC7A11 KMT2A 2115/4885MEN1 2023/4885RXFP1 896/4885
US-20200190020-A1 NOVEL CYSTOBACTAMIDE DERIVATIVES CTH, CBS, SLC7A11 KMT2A 2307/4885MEN1 2097/4885RXFP1 1126/4885

“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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