SCHEMBL24088989

SCHEMBL24088989

CC(=O)NC1COc2cccc(Oc3ccc(Cl)cc3)c2C1

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 6/20 0.52
MTNR1B P49286 3/20 0.42
TP53 P04637 1/20 0.42
POLB P06746 2/20 0.41
MAPT P10636 1/20 0.41
SCN9A Q15858 5/20 0.41
KCNH2 Q12809 3/20 0.41
SCN5A Q14524 3/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL30132640 0.86 TP53 (0.40) MTNR1AMTNR1BTP53POLBMAPT
SCHEMBL19054514 0.86 TP53 (0.40) MTNR1AMTNR1BTP53POLBMAPT
SCHEMBL9786948 0.82 MTNR1A (0.61) MTNR1AMTNR1B
SCHEMBL20554767 0.76 HTT (0.37) MTNR1AMTNR1BPOLBMAPTLMNA
SCHEMBL30132647 0.76 HTT (0.37) MTNR1AMTNR1BPOLBMAPTLMNA
SCHEMBL19054515 0.73 TEAD1 (0.50) MTNR1ASCN9AKCNH2SCN5A
SCHEMBL30132586 0.73 TEAD1 (0.50) MTNR1ASCN9AKCNH2SCN5A
SCHEMBL20554826 0.72 MTNR1A (0.48) MTNR1AMTNR1BMAPT
SCHEMBL4518453 0.72 MTNR1A (0.48) MTNR1AMTNR1BMAPT
SCHEMBL6088362 0.72 MTNR1A (0.71) MTNR1ATP53POLBMAPTLMNA

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-11332455-B2 α,β-unsaturated amide compound KYOWA KIRIN CO., LTD. (JP) 2022-05-17 US disclosed
US-20210380551-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND KYOWA KIRIN CO., LTD. (JP) 2021-12-09 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-20210380551-A1 ALPHA,BETA-UNSATURATED AMIDE COMPOUND NR1H2, NR1H3, NCOA1 MTNR1A 186/4885MTNR1B 372/4885TP53 3092/4885
US-11332455-B2 α,β-unsaturated amide compound NR1H2, NCOA1, NR0B1 MTNR1A 161/4885MTNR1B 371/4885TP53 2960/4885

“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.