SCHEMBL26291385

SCHEMBL26291385

CC(C)(C)OC(=O)N(CC1(C(=O)OC(C)(C)C)CC1)C1CCc2cc(Br)ccc21

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.38
SRD5A1 P18405 1/20 0.32
CCR2 P41597 1/20 0.32
FPR3 P25089 1/20 0.32
FPR2 P25090 1/20 0.32
CXCR3 P49682 1/20 0.32
USP30 Q70CQ3 1/20 0.31
BACE1 P56817 1/20 0.31
AAK1 Q2M2I8 2/20 0.31
FNTA P49354 1/20 0.31
FNTB P49356 1/20 0.31
CCR5 P51681 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CAMK2A Q9UQM7 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
SCHEMBL26291377 0.87 GCGR (0.33) DGAT1SRD5A1CXCR3
SCHEMBL26291395 0.82 NFKB1 (0.31)
SCHEMBL12450286 0.81 ACHE (0.41) SRD5A1
SCHEMBL26291402 0.79 NFKB1 (0.34) SRD5A1USP30AAK1FNTAFNTB
SCHEMBL26291387 0.78 CCR2 (0.40) DGAT1SRD5A1CCR2USP30BACE1
SCHEMBL31730506 0.78 SRD5A1 (0.38) SRD5A1USP30AAK1FNTAFNTB
SCHEMBL23725338 0.77 SRD5A1 (0.33) SRD5A1USP30
SCHEMBL30432457 0.77 SRD5A1 (0.33) SRD5A1USP30
SCHEMBL22517149 0.77 CETP (0.44) CCR2
SCHEMBL31377827 0.77 RIPK1 (0.36) CCR2CXCR3USP30AAK1FNTA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230295076-A1 ACETOPHENONE OXIME COMPOUND AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2023-09-21 US disclosed
US-20230295076-A1 ACETOPHENONE OXIME COMPOUND AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2023-09-21 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 (1 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-20230295076-A1 ACETOPHENONE OXIME COMPOUND AND APPLICATION THEREOF CYP11B2, ALDH7A1, CYP11B1 DGAT1 2858/4885SRD5A1 159/4885CCR2 4388/4885

“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.