SCHEMBL25517038

SCHEMBL25517038

CC(=O)N1CCC([N+](=O)[O-])CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 6/20 0.42
EPHX1 P07099 2/20 0.42
CYP1A2 P05177 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 1/20 0.40
HPGD P15428 1/20 0.40
KDM4E B2RXH2 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
QDPR P09417 1/20 0.38
TXNRD1 Q16881 1/20 0.37
GPR174 Q9BXC1 1/20 0.37

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
SCHEMBL28870451 0.81 HTT (0.31) ALDH1A1HPGD
SCHEMBL25518362 0.79 ALDH1A1 (0.40) CYP1A2ALDH1A1KDM4EGPR174
SCHEMBL4264946 0.79 POLB (0.54) SMN1; SMN2
SCHEMBL25517550 0.78 CHRNB2 (0.45) CYP1A2TDP1ALDH1A1HPGDKDM4E
SCHEMBL16136078 0.74 HPGD (0.53) EPHX1ALDH1A1HPGDKDM4ESMN1; SMN2
SCHEMBL30674690 0.73 HTT (0.30)
SCHEMBL12658989 0.73 NCF1 (0.36) ALDH1A1HPGD
SCHEMBL329321 0.72 CYP1A2 (0.52) EPHX2EPHX1CYP1A2TDP1KDM4E
SCHEMBL18763886 0.72 EPHX2 (0.38) EPHX2EPHX1CYP1A2TDP1ALDH1A1
SCHEMBL4550276 0.70 SMN1; SMN2 (0.52) EPHX2EPHX1CYP1A2TDP1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025011610-A1 AMIDE DERIVATIVE, AND COMPOSITION AND USE THEREOF 深圳市塔吉瑞生物医药有限公司 2025-01-16 WO disclosed
CN-119306790-A Amide derivative, composition and use thereof 深圳市塔吉瑞生物医药有限公司 2025-01-14 CN disclosed
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-25 US disclosed
US-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION COCRYSTAL PHARMA, INC. 2023-05-25 US disclosed
EP-4132944-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION Cocrystal Pharma, Inc. (US) 2023-02-15 EP disclosed
CN-115698035-A Inhibitors of norovirus and coronavirus replication 共晶制药公司 2023-02-03 CN 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-20230159453-A1 INHIBITORS OF NOROVIRUS AND CORONAVIRUS REPLICATION VIM, ACE, ACE2 EPHX2 4754/4885EPHX1 4282/4885CYP1A2 1189/4885

“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.