SCHEMBL24645453

SCHEMBL24645453

CC(C)(C)OC(=O)N1CC(c2cccnc2)C[C@@H]1C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTRA1 Q92743 1/20 0.48
GPR119 Q8TDV5 2/20 0.44
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
HIF1A Q16665 1/20 0.41
RIPK1 Q13546 1/20 0.40
LMNA P02545 1/20 0.39
BLM P54132 1/20 0.38
ALOX15 P16050 1/20 0.38
GBA1 P04062 1/20 0.38

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
SCHEMBL30181325 0.89 MMP2 (0.47) HTRA1GPR119KDM4EMEN1ALDH1A1
SCHEMBL24645494 0.87 HTRA1 (0.45) HTRA1GPR119
SCHEMBL1243964 0.86 HTRA1 (0.60) HTRA1GPR119MEN1KMT2A
SCHEMBL205497 0.86 HTRA1 (0.60) HTRA1GPR119MEN1KMT2A
SCHEMBL9543379 0.86 HTRA1 (0.60) HTRA1GPR119MEN1KMT2A
SCHEMBL1782234 0.86 HTRA1 (0.60) HTRA1GPR119MEN1KMT2A
SCHEMBL2239296 0.86 HTRA1 (0.60) HTRA1GPR119MEN1KMT2A
SCHEMBL5201925 0.86 HTRA1 (0.60) HTRA1GPR119MEN1KMT2A
SCHEMBL4195796 0.86 HTRA1 (0.60) HTRA1GPR119MEN1KMT2A
SCHEMBL5203691 0.86 HTRA1 (0.60) HTRA1GPR119MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220305011-A1 FACTOR XIIA INHIBITORS UNIVERSITY OF LEEDS (GB) 2022-09-29 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-20220305011-A1 FACTOR XIIA INHIBITORS F11, F13B, F12 HTRA1 129/4885GPR119 4204/4885KDM4E 722/4885

“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.