SCHEMBL18966651

SCHEMBL18966651

CCOC(=O)c1cccc2c1OB(O)[C@@H](NC(=O)CCCC(F)(F)F)C2

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 2/20 0.33
▸ TDP1 Q9NUW8 3/20 0.33
▸ L3MBTL1 Q9Y468 2/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ PDK2 Q15119 1/20 0.32
▸ NPSR1 Q6W5P4 2/20 0.32
▸ TP53 P04637 2/20 0.32
▸ CNR2 P34972 1/20 0.32
▸ HTT P42858 1/20 0.32
▸ MAPT P10636 2/20 0.32
▸ NAMPT P43490 1/20 0.31
▸ CDC25B P30305 1/20 0.31
▸ POLB P06746 1/20 0.31
▸ MEN1 O00255 1/20 0.31

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
SCHEMBL18957100 0.95 TSHR (0.35) TSHRTDP1L3MBTL1ALDH1A1KDM4E
SCHEMBL18957099 0.95 TSHR (0.35) TSHRTDP1L3MBTL1ALDH1A1KDM4E
SCHEMBL18966613 0.93 — —
SCHEMBL18966594 0.91 TSHR (0.39) TSHRTDP1L3MBTL1ALDH1A1KDM4E
SCHEMBL18966583 0.91 ALDH1A1 (0.31) TDP1ALDH1A1KDM4ENPSR1MAPT
SCHEMBL18966633 0.91 TSHR (0.34) TSHRTDP1L3MBTL1KMT2APDK2
SCHEMBL18966574 0.91 ALDH1A1 (0.40) TSHRTDP1L3MBTL1ALDH1A1KDM4E
SCHEMBL18966617 0.91 ALDH1A1 (0.40) TSHRTDP1L3MBTL1ALDH1A1KDM4E
SCHEMBL18966621 0.91 ALDH1A1 (0.35) TSHRALDH1A1
SCHEMBL18966575 0.90 EGFR (0.33) CNR2NAMPT

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-10464952-B2 Beta-lactamase inhibitors VenatoRx Pharmaceuticals, Inc. (US) 2019-11-05 — — US disclosed
WO-2017100537-A1 BETA-LACTAMASE INHIBITORS VenatoRx Pharmaceuticals, Inc. (US) 2017-06-15 — — 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 (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-10464952-B2 Beta-lactamase inhibitors MGAM, GAA, LCT TSHR 4759/4885TDP1 1647/4885L3MBTL1 89/4885

“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.

Send feedback