SCHEMBL16569153

SCHEMBL16569153

CC(C)(C)[Si](OC[C@H]1C[C@]1(F)C(=O)O)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CYP3A4 P08684 2/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ SMYD2 Q9NRG4 3/20 0.39
▸ GRM2 Q14416 2/20 0.34
▸ ABL1 P00519 1/20 0.32
▸ HTR2A P28223 3/20 0.31
▸ HTR2C P28335 3/20 0.31
▸ HTR2B P41595 3/20 0.31
▸ SLC6A2 P23975 1/20 0.30
▸ MAOB P27338 1/20 0.30

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
SCHEMBL18730056 1.00 CYP3A4 (0.41) CYP3A4HTTSMN1; SMN2SMYD2GRM2
SCHEMBL10188799 0.81 SLC6A2 (0.41) CYP3A4HTTSMN1; SMN2SMYD2HTR2C
SCHEMBL30158926 0.81 CYP3A4 (0.41) CYP3A4HTTSMN1; SMN2SMYD2HTR2A
SCHEMBL30158890 0.81 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2HTR2A
SCHEMBL30159212 0.81 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2HTR2A
SCHEMBL18632298 0.81 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2HTR2A
SCHEMBL17959779 0.81 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2HTR2A
SCHEMBL30159129 0.81 SMYD2 (0.39) CYP3A4HTTSMN1; SMN2SMYD2HTR2A
SCHEMBL19689355 0.81 CYP3A4 (0.41) CYP3A4HTTSMN1; SMN2SMYD2HTR2A
SCHEMBL19689354 0.81 CYP3A4 (0.41) CYP3A4HTTSMN1; SMN2SMYD2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10441576-B2 Substituted 1,2-dihydro-3H pyrrolo[1,2-c]imidazol-3 one antibacterials IDORSIA PHARMACEUTICALS LTD. (CH) 2019-10-15 — — US disclosed
EP-3334737-B1 SUBSTITUTED 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE ANTIBACTERIAL COMPOUNDS IDORSIA PHARMACEUTICALS LTD (CH) 2019-10-09 — — EP disclosed
EP-3221300-B1 ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2019-03-20 — — EP disclosed
US-20190031676-A1 ANTIBACTERIAL ANNULATED PYRROLIDIN-2-ONE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2019-01-31 — — US disclosed
EP-3114126-B1 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS IDORSIA PHARMACEUTICALS LTD (CH) 2018-10-31 — — EP disclosed
US-10106544-B2 1,2-dihydro-3H-pyrrolo[1,2-C]imidazol-3-one derivatives and their use as antibacterial agents IDORSIA PHARMACEUTICALS LTD (CH) 2018-10-23 — — US disclosed
US-20180235938-A1 SUBSTITUTED 1,2-DIHYDRO-3H PYRROLO[1,2-c]IMIDAZOL-3 ONE ANTIBACTERIALS IDORSIA PHARMACEUTICALS LTD. (CH) 2018-08-23 — — US disclosed
EP-3143007-B1 ANTIBACTERIAL QUINAZOLINE-4(3H)-ONE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2018-07-11 — — EP disclosed
US-20170355687-A1 ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2017-12-14 — — US disclosed
US-9796686-B2 Antibacterial quinazoline-4(3H)-one derivatives IDORSIA PHARMACEUTICALS LTD (CH) 2017-10-24 — — US disclosed
US-20170107223-A1 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS IDORSIA PHARMACEUTICALS LTD (CH) 2017-04-20 — — US disclosed
US-20170081292-A1 ANTIBACTERIAL QUINAZOLINE-4(3H)-ONE DERIVATIVES IDORSIA PHARMACEUTICALS LTD (CH) 2017-03-23 — — US disclosed
EP-3044211-A1 ANTIBACTERIAL 2H-INDAZOLE DERIVATIVES Actelion Pharmaceuticals Ltd (CH) 2016-07-20 — — EP disclosed
WO-2015036964-A1 ANTIBACTERIAL 2H-INDAZOLE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2015-03-19 — — 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 (7 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-20170081292-A1 ANTIBACTERIAL QUINAZOLINE-4(3H)-ONE DERIVATIVES MRPL21, PYM1, MDK CYP3A4 591/4885HTT 1854/4885SMN1; SMN2 4628/4885
US-20180235938-A1 SUBSTITUTED 1,2-DIHYDRO-3H PYRROLO[1,2-c]IMIDAZOL-3 ONE ANTIBACTERIALS CTSH, MRPL21, CASP3 CYP3A4 805/4885HTT 3689/4885SMN1; SMN2 1933/4885
US-10106544-B2 1,2-dihydro-3H-pyrrolo[1,2-C]imidazol-3-one derivatives and their use as antibacterial agents CCNI, H1-0, H1-3 CYP3A4 2381/4885HTT 2581/4885SMN1; SMN2 2848/4885
US-20190031676-A1 ANTIBACTERIAL ANNULATED PYRROLIDIN-2-ONE DERIVATIVES PYCR1, PSPH, RPSA CYP3A4 3357/4885HTT 4041/4885SMN1; SMN2 2118/4885
US-10441576-B2 Substituted 1,2-dihydro-3H pyrrolo[1,2-c]imidazol-3 one antibacterials CTSH, MRPL21, CASP3 CYP3A4 805/4885HTT 3689/4885SMN1; SMN2 1933/4885
US-20170107223-A1 1,2-DIHYDRO-3H-PYRROLO[1,2-C]IMIDAZOL-3-ONE DERIVATIVES AND THEIR USE AS ANTIBACTERIAL AGENTS CCNI, H1-0, H1-3 CYP3A4 2381/4885HTT 2581/4885SMN1; SMN2 2848/4885
US-20170355687-A1 ANTIBACTERIAL BENZOTHIAZOLE DERIVATIVES CYP8B1, TUBB, DRD3 CYP3A4 1095/4885HTT 853/4885SMN1; SMN2 4863/4885

“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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