SCHEMBL17775426

SCHEMBL17775426

CC(C)OC(=O)c1ccc(NC(=O)c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2O)c(OC(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 10/20 0.55
▸ MEN1 O00255 5/20 0.53
▸ KMT2A Q03164 5/20 0.53
▸ HTT P42858 4/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ NPC1 O15118 3/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.48
▸ KDM4E B2RXH2 2/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ TP53 P04637 1/20 0.48
▸ HPGD P15428 1/20 0.48
▸ NPSR1 Q6W5P4 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ KCNMA1 Q12791 1/20 0.46
▸ EP300 Q09472 1/20 0.46
▸ HIF1A Q16665 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.44
▸ CD40 P25942 1/20 0.43
▸ CD40LG P29965 1/20 0.43

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
SCHEMBL17775423 0.96 MAPT (0.50) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL17775424 0.95 MAPT (0.50) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL17775428 0.93 KCNMA1 (0.50) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL16392516 0.92 KCNMA1 (0.52) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL16392538 0.92 MAPT (0.47) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL16392543 0.91 MAPT (0.56) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL16392503 0.88 MAPT (0.45) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL17775425 0.87 EP300 (0.54) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL17775427 0.87 KLKB1 (0.45) MAPTMEN1KMT2AHTTRAB9A
SCHEMBL16392530 0.85 TUBB4A (0.49) MAPTMEN1KMT2AHTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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

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

For each of this compound's patents that has machine-readable text (1 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

“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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