SCHEMBL16371053

SCHEMBL16371053

Cc1c(C(=O)O)ccc(NC(=O)c2ccc(NC(=O)c3ccc(N)cc3)c(OC(C)C)c2O)c1OC(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ TDP1 Q9NUW8 3/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ EP300 Q09472 2/20 0.41
▸ RAB9A P51151 5/20 0.40
▸ NPC1 O15118 4/20 0.40
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ PPARG P37231 1/20 0.39
▸ NR1H4 Q96RI1 1/20 0.39
▸ LMNA P02545 2/20 0.38
▸ POLB P06746 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ GAA P10253 2/20 0.38
▸ TP53 P04637 1/20 0.38

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
SCHEMBL28514797 0.90 EP300 (0.37) MAPTMEN1KMT2ATDP1ALDH1A1
SCHEMBL24379800 0.85 MEN1 (0.54) MAPTMEN1KMT2ATDP1ALDH1A1
SCHEMBL16392463 0.85 EP300 (0.57) MEN1KMT2AEP300RAB9ALMNA
SCHEMBL17775416 0.82 EP300 (0.48) MAPTMEN1KMT2AEP300RAB9A
SCHEMBL15956564 0.81 MAPT (0.50) MAPTMEN1KMT2ATDP1ALDH1A1
SCHEMBL16371049 0.81 MAPT (0.48) MAPTALDH1A1EP300RAB9ANPC1
SCHEMBL17784953 0.80 EP300 (0.56) MAPTMEN1KMT2AEP300RAB9A
SCHEMBL28525198 0.79 EP300 (0.48) MAPTMEN1KMT2AEP300RAB9A
SCHEMBL20786981 0.78 MITF (0.42) MAPTMEN1KMT2AALDH1A1HTT
SCHEMBL24379797 0.78 EP300 (0.53) MAPTMEN1KMT2ATDP1ALDH1A1

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 9 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
CN-105793424-B Ascomycetes amides 亥姆霍兹感染研究中心有限公司 2021-02-19 — — CN 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
EP-3019615-A2 CYSTOBACTAMIDES Helmholtz-Zentrum für Infektionsforschung GmbH (DE) 2016-05-18 — — EP 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 MAPT 3395/4885MEN1 1314/4885KMT2A 1531/4885
US-11225503-B2 Crystobactamides PKD2, SLC7A11, CTH MAPT 1600/4885MEN1 1524/4885KMT2A 1984/4885
US-20190185514-A1 CYSTOBACTAMIDES CTH, SLC7A11, SULT2A1 MAPT 3912/4885MEN1 1050/4885KMT2A 1445/4885
US-20200331964-A1 CYSTOBACTAMIDES CTH, SLC7A11, SULT2A1 MAPT 3765/4885MEN1 1286/4885KMT2A 1108/4885
US-10793600-B2 Cystobactamides CTH, SLC7A11, SULT2A1 MAPT 3953/4885MEN1 1099/4885KMT2A 1416/4885

“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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