SCHEMBL22264116

SCHEMBL22264116

CCOC(C)OC(=O)N1CC=Cc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 10/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
LMNA P02545 1/20 0.41
P2RX1 P51575 3/20 0.38
P2RX3 P56373 3/20 0.38
P2RX7 Q99572 2/20 0.38
PTBP1 P26599 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
MAPK1 P28482 1/20 0.33
BCHE P06276 2/20 0.33
GAA P10253 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
NOTUM Q6P988 1/20 0.32
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL8769449 0.85 P2RX4 (0.43) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL6110761 0.84 P2RX4 (0.46) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL205655 0.83 SMN1; SMN2 (0.53) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL29549990 0.83 SMN1; SMN2 (0.53) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL8768858 0.79 P2RX4 (0.43) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL6110401 0.78 P2RX4 (0.64) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL27785934 0.77 P2RX4 (0.58) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL6110992 0.76 SMN1; SMN2 (0.44) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL411007 0.76 SMN1; SMN2 (0.44) P2RX4SMN1; SMN2LMNAP2RX1P2RX3
SCHEMBL29639604 0.76 SMN1; SMN2 (0.44) P2RX4SMN1; SMN2LMNAP2RX1P2RX3

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-11414411-B2 Chemical process for manufacturing monobactam antibiotic and intermediates thereof NOVARTIS AG (CH) 2022-08-16 US disclosed
US-20200239461-A1 CHEMICAL PROCESS FOR MANUFACTURING MONOBACTAM ANTIBIOTIC AND INTERMEDIATES THEREOF SUZHOU NOVARTIS PHARMA TECHNOLOGY CO., LTD. (CN) 2020-07-30 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 (2 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-11414411-B2 Chemical process for manufacturing monobactam antibiotic and intermediates thereof SRR, DCXR, JMJD6 P2RX4 2256/4885SMN1; SMN2 3344/4885LMNA 4393/4885
US-20200239461-A1 CHEMICAL PROCESS FOR MANUFACTURING MONOBACTAM ANTIBIOTIC AND INTERMEDIATES THEREOF SRR, DCXR, JMJD6 P2RX4 2256/4885SMN1; SMN2 3344/4885LMNA 4393/4885

“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.