SCHEMBL20049385

SCHEMBL20049385

CC(C)C(C)c1nc(C(C)(C)C)no1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 1/20 0.34
IDH1 O75874 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
SCHEMBL2605502 0.83 HTT (0.38) PIK3CGIDH1
SCHEMBL10147793 0.79 PIK3CG (0.34) PIK3CGIDH1
SCHEMBL9449998 0.79 PIK3CG (0.34) PIK3CGIDH1
SCHEMBL21180509 0.77 PIK3CG (0.35) PIK3CGIDH1
SCHEMBL14213299 0.76 PIK3CG (0.33) PIK3CGIDH1
SCHEMBL24704040 0.75 PIK3CG (0.32) PIK3CGIDH1
SCHEMBL20049229 0.75 PIK3CG (0.32) PIK3CGIDH1
SCHEMBL23490727 0.73 PIK3CG (0.33) PIK3CGIDH1
SCHEMBL13187109 0.71 ACHE (0.31)
SCHEMBL9963349 0.71 ACHE (0.31)

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
US-11034684-B2 Isoxazole analogs as FXR agonists and methods of use thereof ENANTA PHARMACEUTICALS, INC. (US) 2021-06-15 US disclosed
US-10683291-B2 Heterocyclic compounds for the treatment of disease OPPILAN PHARMA LTD. (GB) 2020-06-16 US disclosed
US-20190292173-A1 COMPOUNDS CONTAINING BENZO[D][1,3]OXATHIOLE, BENZO[D][1,3]OXATHIOLE 3-OXIDE OR BENZO[D][1,3]OXATHIOLE 3,3-DIOXIDE AND METHODS/USES THEREOF AS AGONISTS OF G PROTEIN-COUPLED RECEPTOR 119 PRAMANA PHARMACEUTICALS INC. (CA) 2019-09-26 US disclosed
US-20190241556-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE OPPILAN PHARMA LTD. (GB) 2019-08-08 US disclosed
WO-2018067704-A1 ISOXAZOLE ANALOGS AS FXR AGONISTS AND METHODS OF USE THEREOF ENANTA PHARMACEUTICALS, INC. (US) 2018-04-12 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 (4 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-20190292173-A1 COMPOUNDS CONTAINING BENZO[D][1,3]OXATHIOLE, BENZO[D][1,3]OXATHIOLE 3-OXIDE OR BENZO[D][1,3]OXATHIOLE 3,3-DIOXIDE AND METHODS/USES THEREOF AS AGONISTS OF G PROTEIN-COUPLED RECEPTOR 119 GPR119, GPR3, GPR39 PIK3CG 2177/4885IDH1 3982/4885
US-11034684-B2 Isoxazole analogs as FXR agonists and methods of use thereof GPBAR1, SLC10A1, NR1H4 PIK3CG 3417/4885IDH1 3928/4885
US-20190241556-A1 HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE VHL, FH, TPMT PIK3CG 4011/4885IDH1 26/4885
US-10683291-B2 Heterocyclic compounds for the treatment of disease VHL, FH, TPMT PIK3CG 4011/4885IDH1 26/4885

“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.