SCHEMBL29633776

SCHEMBL29633776

CNC(CCc1ccc(C(=O)N(C)OC2CCCCO2)cc1)C(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ITGB1 P05556 1/20 0.35
ITGA4 P13612 1/20 0.35
MGLL Q99685 2/20 0.35
ACE P12821 2/20 0.35
GAA P10253 1/20 0.34
CREBBP Q92793 2/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
EP300 Q09472 1/20 0.34
OXTR P30559 2/20 0.33
AVPR1A P37288 1/20 0.33
LMNA P02545 1/20 0.33

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
SCHEMBL29633685 0.90 ITGB1 (0.42) MEN1KMT2AITGB1ITGA4ACE
SCHEMBL28741494 0.86 MEN1 (0.38) MEN1KMT2AMGLLGAAOXTR
SCHEMBL30854384 0.82 MGLL (0.41) MEN1KMT2AMGLLGAALMNA
SCHEMBL9506049 0.81 MEN1 (0.46) MEN1KMT2AMGLLOXTRAVPR1A
SCHEMBL29633790 0.81 TLR2 (0.44)
SCHEMBL28741471 0.81 TPH1 (0.41) MEN1KMT2AGAALMNA
SCHEMBL22454527 0.77 MEN1 (0.41) MEN1KMT2ACREBBPEP300OXTR
SCHEMBL11020227 0.76 OXTR (0.40) MEN1KMT2AGAAOXTRAVPR1A
SCHEMBL22454537 0.76 NPC1 (0.41) MEN1KMT2AGAAOXTRAVPR1A
SCHEMBL22454696 0.75 KMT2A (0.40) MEN1KMT2AGAAOXTRLMNA

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-20240376044-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE CHUGAI PHARMACEUTICAL CO LTD (JP) 2024-11-14 US disclosed
US-12071396-B2 Method for preparing aromatic amino acid derivative CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-08-27 US disclosed
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-05-12 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-20240376044-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR MEN1 3483/4885KMT2A 355/4885ITGB1 4860/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR MEN1 3483/4885KMT2A 355/4885ITGB1 4860/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR MEN1 3483/4885KMT2A 355/4885ITGB1 4860/4885

“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.