SCHEMBL25948458

SCHEMBL25948458

C[C@]1(O)C[C@@H](NC(=O)CCl)C1

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.39
MTNR1B P49286 2/20 0.39
GAA P10253 1/20 0.38
JAK2 O60674 1/20 0.36
ALDH1A1 P00352 1/20 0.36
LMNA P02545 1/20 0.36
RAB9A P51151 1/20 0.36
HPGDS O60760 5/20 0.36
HTT P42858 1/20 0.36
NLRP3 Q96P20 3/20 0.35
KDM4E B2RXH2 1/20 0.35
KMT2A Q03164 1/20 0.35
EPHX2 P34913 1/20 0.34

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
SCHEMBL25332801 1.00 MTNR1A (0.39) MTNR1AMTNR1BGAAJAK2ALDH1A1
SCHEMBL25952839 0.82 MTNR1A (0.40) MTNR1AMTNR1BGAAHPGDSHTT
SCHEMBL20464452 0.82 MTNR1A (0.40) MTNR1AMTNR1BGAAHPGDSHTT
SCHEMBL29494819 0.81 GAA (0.58) GAAHTTKDM4EKMT2A
SCHEMBL228314 0.79 HDAC4 (0.38) MTNR1AMTNR1BGAAJAK2ALDH1A1
SCHEMBL2302250 0.79 MAOB (0.48) MTNR1AMTNR1BGAAJAK2ALDH1A1
SCHEMBL2302254 0.79 GAA (0.50) MTNR1AMTNR1BGAAJAK2ALDH1A1
SCHEMBL18343146 0.78 MTNR1A (0.40) MTNR1AMTNR1BGAAJAK2ALDH1A1
SCHEMBL20313800 0.75 MTNR1A (0.36) MTNR1AMTNR1BGAAJAK2ALDH1A1
SCHEMBL14809937 0.74 POLB (0.36) GAAHPGDSHTTKDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357162-A1 COMPOUNDS, COMPOSITIONS AND METHODS TENVIE THERAPEUTICS, INC. 2023-11-09 US disclosed
US-20230357162-A1 COMPOUNDS, COMPOSITIONS AND METHODS TENVIE THERAPEUTICS, INC. 2023-11-09 US disclosed
US-20230348437-A1 COMPOUNDS, COMPOSITIONS AND METHODS TENVIE THERAPEUTICS, INC. 2023-11-02 US disclosed
WO-2023133271-A1 BICYCLIC PHTHALAZIN-1(2H)-ONE DERIVATIVES AND RELATED USES NodThera Limited (GB) 2023-07-13 WO 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-20230357162-A1 COMPOUNDS, COMPOSITIONS AND METHODS NLRP3, NLRP1, NOD1 MTNR1A 3778/4885MTNR1B 3871/4885GAA 4485/4885
US-20230348437-A1 COMPOUNDS, COMPOSITIONS AND METHODS NLRP3, NLRP1, NOD1 MTNR1A 3778/4885MTNR1B 3871/4885GAA 4485/4885

“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.