SCHEMBL22184151

SCHEMBL22184151

C=C(C)CC(=O)NCCCc1occc1OC

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 2/20 0.42
MTNR1B P49286 2/20 0.42
MEN1 O00255 1/20 0.40
KMT2A Q03164 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
SCHEMBL22184129 0.85 MTNR1A (0.50) MTNR1AMTNR1BMEN1KMT2A
SCHEMBL22184132 0.84 MTNR1A (0.44) MTNR1AMTNR1BMEN1KMT2A
SCHEMBL25814254 0.84 MTNR1A (0.42) MTNR1AMTNR1BMEN1KMT2A
SCHEMBL22184085 0.80 POLB (0.41)
SCHEMBL25816016 0.79 BCHE (0.37)
SCHEMBL22184128 0.77 POLB (0.39)
SCHEMBL20570535 0.72 HPGD (0.46) KMT2A
SCHEMBL20570855 0.71 RXFP1 (0.41)
Acetic Acid SCHEMBL23925788 0.70 ACHE (0.36)
SCHEMBL23948510 0.68 TNKS2 (0.37) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230321267-A1 Method And Molecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2023-10-12 US disclosed
US-11759526-B2 Method and molecules MEDIMMUNE, LLC (US) 2023-09-19 US disclosed
US-20200206359-A1 Method And Molecules THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2020-07-02 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 (3 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-20200206359-A1 Method And Molecules PAICS, EPCAM, SQLE MTNR1A 2468/4885MTNR1B 2502/4885MEN1 1899/4885
US-20230321267-A1 Method And Molecules PAICS, EPCAM, SQLE MTNR1A 2468/4885MTNR1B 2502/4885MEN1 1899/4885
US-11759526-B2 Method and molecules PAICS, EPCAM, SQLE MTNR1A 2468/4885MTNR1B 2502/4885MEN1 1899/4885

“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.