SCHEMBL25124087

SCHEMBL25124087

CCCCC/C=C\C/C=C\CCCCCCCCN(CCCCCCCC/C=C\C/C=C\CCCCC)CCCNC(=O)c1cc(C)cc(C=O)c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ CNR1 P21554 4/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ TRPV1 Q8NER1 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ ALOX12 P18054 1/20 0.41
▸ BLM P54132 1/20 0.41
▸ KMT2A Q03164 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL22767927 0.87 CNR1 (0.50) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL24849910 0.86 DRD2 (0.47) L3MBTL1
SCHEMBL22767950 0.82 CNR1 (0.46) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL22767939 0.82 EPHX2 (0.43) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL24849911 0.80 POLB (0.42) L3MBTL1MEN1KMT2A
SCHEMBL25124091 0.77 EPHX2 (0.43) L3MBTL1ALDH1A1HPGDMAPTTDP1
SCHEMBL22391191 0.77 SMN1; SMN2 (0.57) L3MBTL1
SCHEMBL22767943 0.74 EPHX2 (0.47) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL22767782 0.74 EPHX2 (0.47) CNR1ALDH1A1HPGDTRPV1MEN1
SCHEMBL16158101 0.73 CNR1 (0.52) CNR1ALDH1A1HPGDTRPV1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11622942-B2 Benzene-1,3,5-tricarboxamide derived ester lipids and uses thereof OHIO STATE INNOVATION FOUNDATION (US) 2023-04-11 — — 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 (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-11622942-B2 Benzene-1,3,5-tricarboxamide derived ester lipids and uses thereof LIPA, LIPC, CES1 L3MBTL1 698/4885CNR1 116/4885ALDH1A1 456/4885

“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.

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