SCHEMBL17464375

SCHEMBL17464375

COC(=O)c1cc(B2OC(C)(C)C(C)(C)O2)cnc1C

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.44
GSK3A P49840 1/20 0.41
GSK3B P49841 1/20 0.41
PDGFRB P09619 5/20 0.41
KDR P35968 5/20 0.41
ALPL P05186 1/20 0.38
HIF1A Q16665 2/20 0.37
GAA P10253 1/20 0.35
ROCK2 O75116 1/20 0.35
MAPT P10636 1/20 0.34
KMT2A Q03164 1/20 0.34
UCHL1 P09936 1/20 0.34
AAK1 Q2M2I8 1/20 0.34
USP30 Q70CQ3 1/20 0.34

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
SCHEMBL30963226 1.00 DGAT1 (0.44) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL16077123 0.91 DGAT1 (0.40) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL21198942 0.86 GSK3A (0.42) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL29604376 0.86 GSK3A (0.42) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL19806132 0.86 DGAT1 (0.44) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL29858041 0.85 PDGFRB (0.50) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL29604061 0.85 ALPL (0.46) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL21199260 0.85 DGAT1 (0.44) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL789862 0.85 ALPL (0.46) DGAT1GSK3AGSK3BPDGFRBKDR
SCHEMBL26660219 0.85 DGAT1 (0.44) DGAT1GSK3AGSK3BPDGFRBKDR

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-11229638-B2 Therapeutic heterocyclic compounds GILEAD SCIENCES, INC. (US) 2022-01-25 US disclosed
US-20200316035-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS GILEAD SCIENCES, INC. 2020-10-08 US disclosed
US-9738653-B2 Fused furans for the treatment of hepatitis C BRISTOL-MYERS SQUIBB COMPANY (US) 2017-08-22 US disclosed
US-20160024103-A1 FUSED FURANS FOR THE TREATMENT OF HEPATITIS C BRISTOL-MYERS SQUIBB COMPANY 2016-01-28 US 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 (3 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-11229638-B2 Therapeutic heterocyclic compounds SDHA, CYP11B2, ABCB1 DGAT1 3302/4885GSK3A 3673/4885GSK3B 3385/4885
US-20200316035-A1 THERAPEUTIC HETEROCYCLIC COMPOUNDS SDHA, CYP11B2, ABCB1 DGAT1 3302/4885GSK3A 3673/4885GSK3B 3385/4885
US-20160024103-A1 FUSED FURANS FOR THE TREATMENT OF HEPATITIS C HAVCR2, HCCS, GOT1 DGAT1 1589/4885GSK3A 3809/4885GSK3B 3841/4885

“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.