SCHEMBL22697116

SCHEMBL22697116

CC(=O)N[C@H](C(=O)OCc1ccccc1)C1CCCC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
EPHX1 P07099 1/20 0.49
ALDH1A1 P00352 3/20 0.48
GAA P10253 1/20 0.48
TACR1 P25103 1/20 0.47
TSHR P16473 1/20 0.46
DPP4 P27487 1/20 0.46
KCNH2 Q12809 1/20 0.46
DPP7 Q9UHL4 1/20 0.46
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
FKBP1A P62942 2/20 0.45
L3MBTL1 Q9Y468 1/20 0.44

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
SCHEMBL22697290 0.94 ALDH1A1 (0.50) CYP3A4CYP2C9CYP2C19ALDH1A1GAA
SCHEMBL32677628 0.86 CYP3A4 (0.53) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1
SCHEMBL25597961 0.85 DPP4 (0.50) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1
SCHEMBL25597434 0.85 DPP4 (0.50) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1
SCHEMBL25597432 0.84 CYP3A4 (0.49) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1
SCHEMBL8234039 0.83 CTSL (0.59) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1
SCHEMBL20825664 0.82 EPHX1 (0.56) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1
SCHEMBL25597428 0.80 CYP3A4 (0.58) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1
SCHEMBL7810127 0.80 ALDH1A1 (0.54) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1
SCHEMBL7333566 0.80 ALDH1A1 (0.54) CYP3A4CYP2C9CYP2C19EPHX1ALDH1A1

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-20230257388-A1 GRANZYME B DIRECTED IMAGING AND THERAPY CYTOSITE BIOPHARMA INC. (US) 2023-08-17 US disclosed
US-20230257388-A1 GRANZYME B DIRECTED IMAGING AND THERAPY CYTOSITE BIOPHARMA INC. (US) 2023-08-17 US disclosed
US-11667645-B2 Granzyme B directed imaging and therapy CYTOSITE BIOPHARMA INC. (US) 2023-06-06 US disclosed
US-11667645-B2 Granzyme B directed imaging and therapy CYTOSITE BIOPHARMA INC. (US) 2023-06-06 US disclosed
US-20200369673-A1 GRANZYME B DIRECTED IMAGING AND THERAPY CYTOSITE BIOPHARMA INC. 2020-11-26 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-20230257388-A1 GRANZYME B DIRECTED IMAGING AND THERAPY GZMB, PRF1, CTSB CYP3A4 3130/4885CYP2C9 4370/4885CYP2C19 3540/4885
US-20200369673-A1 GRANZYME B DIRECTED IMAGING AND THERAPY GZMB, PRF1, CTSB CYP3A4 3130/4885CYP2C9 4370/4885CYP2C19 3540/4885
US-11667645-B2 Granzyme B directed imaging and therapy GZMB, PRF1, CTSB CYP3A4 3130/4885CYP2C9 4370/4885CYP2C19 3540/4885

“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.