SCHEMBL22233303

SCHEMBL22233303

CC(C)(C)OC(=O)/N=C(/NC(=O)OC(C)(C)C)NC1CCNCC1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 6/20 0.40
GAA P10253 2/20 0.38
POLB P06746 1/20 0.37
BTK Q06187 1/20 0.36
CTSK P43235 2/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
GNAI3 P08754 1/20 0.33
GNAO1 P09471 1/20 0.33
GNAI1 P63096 1/20 0.33
SSTR1 P30872 1/20 0.33
SSTR4 P31391 1/20 0.33
KDM1A O60341 1/20 0.33
MAOB P27338 1/20 0.33
HTR4 Q13639 1/20 0.32
EPHX2 P34913 1/20 0.32

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
SCHEMBL22233304 1.00 EPHX1 (0.40) EPHX1GAAPOLBBTKCTSK
SCHEMBL18256753 0.85 GAA (0.39) EPHX1GAABTKCTSKNFKB1
SCHEMBL19508986 0.85 GAA (0.39) EPHX1GAABTKCTSKNFKB1
SCHEMBL21580368 0.80 BTK (0.49) EPHX1GAABTKCTSKNFKB1
SCHEMBL56856 0.79 EPHX1 (0.53) EPHX1GAAPOLBBTKCTSK
SCHEMBL15632420 0.78 BTK (0.39) BTKCTSKHTR4
Hydrochloric Acid SCHEMBL4158527 0.78 EPHX1 (0.52) EPHX1GAAPOLBBTKCTSK
Ammonia Solution, Strong SCHEMBL15021680 0.78 EPHX1 (0.52) EPHX1GAAPOLBBTKCTSK
Water SCHEMBL27795194 0.78 EPHX1 (0.52) EPHX1GAAPOLBBTKCTSK
SCHEMBL15489159 0.77 BTK (0.35) EPHX1GAABTKCTSKNFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12503452-B2 Antimicrobial compounds and methods CURZA GLOBAL, LLC (US) 2025-12-23 US disclosed
US-20230159491-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-05-25 US disclosed
EP-3911644-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
WO-2020150385-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 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 (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-20230159491-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 EPHX1 4311/4885GAA 173/4885POLB 108/4885
US-12503452-B2 Antimicrobial compounds and methods MPO, NISCH, RPN2 EPHX1 4311/4885GAA 173/4885POLB 108/4885

“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.