SCHEMBL14199911

SCHEMBL14199911

Cc1ccc(C(=O)NCCCOc2ccc(C=O)cc2)c([N+](=O)[O-])c1OCc1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 7/20 0.43
▸ KMT2A Q03164 7/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ NPC1 O15118 3/20 0.43
▸ LMNA P02545 2/20 0.43
▸ MAPT P10636 5/20 0.42
▸ HPGD P15428 2/20 0.42
▸ POLB P06746 2/20 0.42
▸ LTA4H P09960 5/20 0.41
▸ HTT P42858 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ SLC6A5 Q9Y345 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL14199916 0.89 HPGD (0.44) MEN1KMT2AKDM4ENPC1LMNA
SCHEMBL14450789 0.84 HPGD (0.47) MEN1KMT2ANPC1MAPTHPGD
SCHEMBL14199914 0.84 HPGD (0.47) MEN1KMT2ANPC1MAPTHPGD
SCHEMBL14199904 0.83 MEN1 (0.52) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL14199912 0.83 HPGD (0.46) MEN1KMT2ANPC1LMNAMAPT
SCHEMBL12253976 0.82 SIGMAR1 (0.45) KDM4ENPC1MAPTHPGDPOLB
SCHEMBL12779413 0.78 MEN1 (0.47) MEN1KMT2ALMNAMAPTRAB9A
SCHEMBL12253970 0.76 PTPN1 (0.47) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL12253971 0.74 ALDH1A1 (0.46) KMT2AMAPTPOLBTDP1L3MBTL1
SCHEMBL12778251 0.74 MEN1 (0.47) MEN1KMT2AKDM4ENPC1LMNA

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-8778874-B2 Glycopeptide antibiotic monomer derivatives NATIONAL UNIVERSITY CORPORATION NAGOYA UNIVERSITY (JP) 2014-07-15 — — US disclosed
US-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria SHIONOGI & CO., LTD. (JP) 2008-04-24 — — 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-20080097078-A1 Antibacterial activity against vancomycin-resistant bacteria CSGALNACT1, MON2, NR2C2 MEN1 4301/4885KMT2A 2424/4885KDM4E 4340/4885

“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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