SCHEMBL67611

SCHEMBL67611

COc1cc(OC=O)c([N+](=O)[O-])cc1OC

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.62
MAPT P10636 5/20 0.62
KDM4E B2RXH2 2/20 0.62
CYP3A4 P08684 1/20 0.62
ALOX15 P16050 1/20 0.62
PRKDC P78527 1/20 0.62
HSD17B10 Q99714 1/20 0.62
TDP1 Q9NUW8 3/20 0.46
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44
TUBA3C P0DPH7 1/20 0.44
TUBA1B P68363 1/20 0.44
TUBA4A P68366 1/20 0.44
TUBB4B P68371 1/20 0.44
TUBB3 Q13509 1/20 0.44
TUBB2A Q13885 1/20 0.44
TUBB8 Q3ZCM7 1/20 0.44
TUBA3E Q6PEY2 1/20 0.44
TUBA1A Q71U36 1/20 0.44
TUBA1C Q9BQE3 1/20 0.44

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
SCHEMBL2087809 0.85 ALDH1A1 (0.63) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL210330 0.80 ALDH1A1 (0.68) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL29800558 0.80 ALDH1A1 (0.68) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL10778338 0.80 ALDH1A1 (0.62) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL28620392 0.79 ALDH1A1 (0.58) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL6370055 0.78 ALDH1A1 (0.57) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL28196003 0.78 TUBB4A (0.51) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL95595 0.78 ALDH1A1 (0.56) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL11135612 0.77 ALDH1A1 (0.58) ALDH1A1MAPTKDM4ECYP3A4ALOX15
SCHEMBL19083207 0.76 ATM (0.40) ALDH1A1MAPTKDM4ECYP3A4ALOX15

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 1014 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11891668-B2 Methods for generating therapeutic delivery platforms THE UNIVERSITY OF KANSAS (US) 2024-02-06 US claimed
US-20230373962-A1 SUPRAMOLECULAR MOLECULES FOR THE TREATMENT OF CANCER THE UNIVERSITY OF BIRMINGHAM (GB) 2023-11-23 US claimed
CN-115350659-A Method for preparing capsules sensitive to pH or ultraviolet radiation and capsules obtained thereby 卡莉西亚公司 2022-11-18 CN claimed
CN-111344057-B Method for preparing capsules sensitive to pH or ultraviolet radiation and capsules obtained thereby 卡莉西亚公司 2022-09-27 CN claimed
WO-2022064066-A1 SUPRAMOLECULAR MOLECULES FOR THE TREATMENT OF CANCER THE UNIVERSITY OF BIRMINGHAM (GB) 2022-03-31 WO claimed
CN-107002293-B Sequencing by synthesis using pulsed readout optics 艾比斯生物科学公司 2020-12-08 CN claimed
CN-111344057-A Method for preparing capsules sensitive to pH or ultraviolet radiation and capsules obtained thereby 卡莉西亚公司 2020-06-26 CN claimed
US-20200123605-A1 SEQUENCING BY SYNTHESIS USING PULSE READ OPTICS IBIS BIOSCIENCES, INC. 2020-04-23 US claimed
EP-3194643-B1 SEQUENCING BY SYNTHESIS USING PULSE READ OPTICS IBIS BIOSCIENCES INC (US) 2020-02-19 EP claimed
US-10550428-B2 Sequencing by synthesis using pulse read optics IBIS BIOSCIENCES, INC. (US) 2020-02-04 US claimed
EP-0619321-A1 Very large scale immobilized peptide synthesis AFFYMAX TECHNOLOGIES N.V. (AN) 1994-10-12 EP claimed
EP-0476014-B1 VERY LARGE SCALE IMMOBILIZED POLYMER SYNTHESIS AFFYMAX TECH NV (AN) 1994-08-31 EP claimed
WO-1993022680-A1 SPATIALLY-ADDRESSABLE IMMOBILIZATION OF OLIGONUCLEOTIDES AND OTHER BIOLOGICAL POLYMERS ON SURFACES AFFYMAX TECHNOLOGIES N.V. (AN) 1993-11-11 WO claimed
US-5252743-A Using cage binding compound AFFYMAX TECHNOLOGIES N.V. (NL) 1993-10-12 US claimed
EP-0502060-A4 SPATIALLY-ADDRESSABLE IMMOBILIZATION OF ANTI-LIGANDS ON SURFACES 1993-05-05 EP claimed
EP-0502060-A1 SPATIALLY-ADDRESSABLE IMMOBILIZATION OF ANTI-LIGANDS ON SURFACES AFFYMAX TECHNOLOGIES N.V. (AN) 1992-09-09 EP claimed
US-5143854-A LARGE SCALE PHOTOLITHOGRAPHIC SOLID PHASE SYNTHESIS OF POLYPEPTIDES AND RECEPTOR BINDING SCREENING THEREOF AFFYMAX TECHNOLOGIES N.V. (AN) 1992-09-01 US claimed
EP-0476014-A1 VERY LARGE SCALE IMMOBILIZED POLYMER SYNTHESIS. AFFYMAX TECH NV (NL) 1992-03-25 EP claimed
WO-1991007087-A1 SPATIALLY-ADDRESSABLE IMMOBILIZATION OF ANTI-LIGANDS ON SURFACES AFFYMAX TECHNOLOGIES N.V. (AN) 1991-05-30 WO claimed
WO-1990015070-A1 VERY LARGE SCALE IMMOBILIZED PEPTIDE SYNTHESIS AFFYMAX TECHNOLOGIES N.V. (AN) 1990-12-13 WO claimed

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-20230373962-A1 SUPRAMOLECULAR MOLECULES FOR THE TREATMENT OF CANCER PCNA, DDX1, DDX18 ALDH1A1 4454/4885MAPT 3449/4885KDM4E 3147/4885
US-11891668-B2 Methods for generating therapeutic delivery platforms EXOSC4, EXOSC5, EXOSC9 ALDH1A1 2893/4885MAPT 612/4885KDM4E 806/4885

“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.