SCHEMBL18588192

SCHEMBL18588192

CC(C)(C)OC(=O)N1CC(O)(C#CBr)C1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
HPGD P15428 1/20 0.39
EPHX1 P07099 1/20 0.37
NR1H2 P55055 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
EPHX2 P34913 1/20 0.35
HTT P42858 1/20 0.35
ATM Q13315 1/20 0.35
CTSK P43235 1/20 0.34
RECQL P46063 1/20 0.34
RORC P51449 2/20 0.34
GPR183 P32249 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33

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
SCHEMBL19615485 0.88 USP2 (0.41) USP2SMN1; SMN2HPGDEPHX1EPHX2
SCHEMBL21458082 0.88 USP2 (0.41) USP2SMN1; SMN2HPGDEPHX1EPHX2
SCHEMBL18587326 0.84 USP2 (0.46) USP2SMN1; SMN2HPGDEPHX1MEN1
SCHEMBL25177650 0.82 USP2 (0.40) USP2SMN1; SMN2HPGDEPHX1NR1H2
SCHEMBL18588149 0.82 USP2 (0.40) USP2SMN1; SMN2HPGDEPHX1NR1H2
SCHEMBL17602919 0.81 USP2 (0.42) USP2SMN1; SMN2HPGDEPHX1NR1H2
SCHEMBL25799405 0.80 USP2 (0.38) USP2SMN1; SMN2HPGDEPHX1NR1H2
SCHEMBL18535153 0.79 USP2 (0.43) USP2SMN1; SMN2HPGDEPHX1NR1H2
SCHEMBL28956005 0.79 USP2 (0.43) USP2SMN1; SMN2HPGDEPHX1NR1H2
SCHEMBL992628 0.79 USP2 (0.43) USP2SMN1; SMN2HPGDEPHX1NR1H2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3344630-B1 SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS IDORSIA PHARMACEUTICALS LTD (CH) 2020-12-09 EP disclosed
US-10314823-B2 Substituted 1,2-dihydro-3H-pyrrolo[1,2-c]imidazol-3-one antibacterial compounds IDORSIA PHARMACEUTICALS LTD (CH) 2019-06-11 US disclosed
US-20180250273-A1 SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-c]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS IDORSIA PHARMACEUTICALS LTD. (CH) 2018-09-06 US disclosed
EP-3344630-A1 SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS Idorsia Pharmaceuticals Ltd (CH) 2018-07-11 EP disclosed
WO-2017037221-A1 SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS ACTELION PHARMACEUTICALS LTD (CH) 2017-03-09 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-10314823-B2 Substituted 1,2-dihydro-3H-pyrrolo[1,2-c]imidazol-3-one antibacterial compounds MRPL21, MRM1, MT-CO1 USP2 4611/4885SMN1; SMN2 1346/4885HPGD 2553/4885
US-20180250273-A1 SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-c]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS MRPL21, MRM1, MT-CO1 USP2 4611/4885SMN1; SMN2 1346/4885HPGD 2553/4885

“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.