SCHEMBL25568153

SCHEMBL25568153

COC(=O)CC1(NC(=O)OC(C)(C)C)CCC(C)CC1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 1/20 0.37
CA12 O43570 1/20 0.36
CA2 P00918 1/20 0.36
CA14 Q9ULX7 1/20 0.36
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
EPHX1 P07099 1/20 0.33
ALDH1A1 P00352 1/20 0.32
BTK Q06187 1/20 0.32
CTSL P07711 1/20 0.32
PPIA P62937 1/20 0.31
GAA P10253 1/20 0.31
P2RX7 Q99572 1/20 0.31
APLNR P35414 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
SCHEMBL13010604 0.88 CA2 (0.41) CNR2CA12CA2CA14KMT2A
SCHEMBL8282998 0.84 CA12 (0.42) CNR2CA12CA2CA14KMT2A
SCHEMBL25568150 0.82 DPP4 (0.35) CA12CA2CA14KMT2AMEN1
SCHEMBL25568157 0.82 DPP4 (0.35) CA12CA2CA14KMT2AMEN1
SCHEMBL25568161 0.81 TDP1 (0.36) KMT2AMEN1MAPK1EPHX1ALDH1A1
SCHEMBL25568162 0.81 TDP1 (0.36) KMT2AMEN1MAPK1EPHX1ALDH1A1
SCHEMBL3022379 0.81 CA12 (0.37) CNR2CA12CA2CA14KMT2A
SCHEMBL25568152 0.81 TDP1 (0.36) KMT2AMEN1MAPK1EPHX1ALDH1A1
SCHEMBL23136344 0.79 EPHX1 (0.35) CNR2KMT2AMEN1MAPK1EPHX1
SCHEMBL28142895 0.79 CA12 (0.36) CNR2CA12CA2CA14KMT2A

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-20230159517-A1 CHROMANE AMIDINE MONOBACTAM COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS MERCK SHARP & DOHME LLC (US) 2023-05-25 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-20230159517-A1 CHROMANE AMIDINE MONOBACTAM COMPOUNDS FOR THE TREATMENT OF BACTERIAL INFECTIONS TCOF1, SLC10A2, PAM CNR2 2237/4885CA12 58/4885CA2 96/4885

“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.