SCHEMBL6070434

SCHEMBL6070434

O=C(O)[C@@H]1O[C@H]1c1ccc(Cl)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 4/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
TP53 P04637 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
HPGD P15428 1/20 0.47
CYP2C19 P33261 1/20 0.47
PTGS2 P35354 1/20 0.43
TSHR P16473 2/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
FTO Q9C0B1 2/20 0.41
ALOX15 P16050 1/20 0.40
MAPK1 P28482 1/20 0.40
RET P07949 1/20 0.39
KDR P35968 1/20 0.39
PPM1B O75688 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.37

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
SCHEMBL6070420 1.00 EPHX1 (0.48) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL9264620 1.00 EPHX1 (0.48) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL6919663 1.00 EPHX1 (0.48) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL6069547 1.00 EPHX1 (0.48) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL28633045 0.98 EPHX1 (0.47) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL15307543 0.83 EPHX1 (0.67) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL3343090 0.83 EPHX1 (0.67) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL6689012 0.83 EPHX1 (0.67) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL9458781 0.83 EPHX1 (0.67) EPHX1MEN1KMT2ATP53CYP1A2
SCHEMBL2533818 0.83 EPHX1 (0.67) EPHX1MEN1KMT2ATP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7056947-B2 For inhibiting (cysteine) proteases/caspases; for treatment of viral infections, stroke, neurodegenerative disease, and inflammatory diseases GEORGIA TECH RESEARCH CORP. (US) 2006-06-06 US disclosed
US-20040048327-A1 Aza-peptide epoxides NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2004-03-11 US disclosed
EP-0157327-B1 NOVEL COMPOUNDS FOR DETECTING THE PRESENCE OF HYDROLYTIC ANALYTES IN A TEST SAMPLE MILES INC. (US) 1991-06-12 EP disclosed
EP-0158204-B1 COMPOSITION AND TEST DEVICE FOR DETERMINING THE PRESENCE OF LEUKOCYTES, CONTAINING A ZWITTERION COUPLING AGENT MILES INC. (US) 1989-11-23 EP disclosed
EP-0157326-B1 COMPOSITION AND TEST DEVICE FOR DETERMINING THE PRESENCE OF LEUKOCYTES, ESTERASE AND PROTEASE IN A TEST SAMPLE MILES INC. (US) 1989-05-31 EP disclosed
US-4774340-A AMINATION, CYCLIZATION, ESTERIFICATION MILES INC. (US) 1988-09-27 US disclosed
US-4716236-A Method for synthesizing esters MILES LABORATORIES, INC. (US) 1987-12-29 US disclosed
US-4704460-A LEUKOCYTES IN URINE MILES LABORATORIES, INC. (US) 1987-11-03 US disclosed
US-4657855-A DIP-AND-READ, UROGENITAL DISORDERS MILES LABORATORIES, INC. (US) 1987-04-14 US disclosed
US-4645842-A DETECTING LEUKOCYTES TO INDICATE KIDNEY OR UROGENITAL DISORDERS MILES LABORATORIES, INC. (US) 1987-02-24 US disclosed
US-4637979-A Composition and test device for determining the presence of leukocytes containing a zwitterion coupling agent MILES LABORATORIES, INC. (US) 1987-01-20 US disclosed
EP-0158204-A2 Composition and test device for determining the presence of leukocytes, containing a zwitterion coupling agent MILES INC. (US) 1985-10-16 EP disclosed
EP-0158226-A2 Method of synthesizing esters MILES INC. (US) 1985-10-16 EP disclosed
EP-0157327-A2 Novel compounds for detecting the presence of hydrolytic analytes in a test sample MILES INC. (US) 1985-10-09 EP disclosed
EP-0157326-A2 Composition and test device for determining the presence of leukocytes, esterase and protease in a test sample MILES INC. (US) 1985-10-09 EP 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-20040048327-A1 Aza-peptide epoxides ANPEP, ENPEP, TMPRSS15 EPHX1 13/4885MEN1 3405/4885KMT2A 2281/4885

“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.