SCHEMBL29633844

SCHEMBL29633844

CNC(CCc1cncc(OC)c1)C(=O)O

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.42
CYP11B2 P19099 4/20 0.42
KCNH2 Q12809 1/20 0.41
GPR132 Q9UNW8 2/20 0.38
KDM1A O60341 1/20 0.38
MAOA P21397 1/20 0.38
MAOB P27338 1/20 0.38
MMP3 P08254 2/20 0.36
MAPK1 P28482 1/20 0.36
MKNK1 Q9BUB5 1/20 0.35
MKNK2 Q9HBH9 1/20 0.35

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
SCHEMBL29633710 0.86 CYP11B1 (0.44) CYP11B1CYP11B2KCNH2KDM1AMAOA
SCHEMBL31370050 0.84 MAPK1 (0.45) MAPK1
SCHEMBL22444608 0.81 FOLH1 (0.39) GPR132MAPK1
SCHEMBL28741528 0.81 KIF11 (0.42) CYP11B1CYP11B2KCNH2MKNK1MKNK2
SCHEMBL31369409 0.80 CHRM2 (0.54)
SCHEMBL22444713 0.80 CHRM2 (0.54)
SCHEMBL20467759 0.79 LDHA (0.54) MMP3
SCHEMBL22444729 0.79 LDHA (0.54) MMP3
SCHEMBL16078668 0.79 LDHA (0.54) MMP3
SCHEMBL28940617 0.77 MKNK1 (0.39) CYP11B1CYP11B2KCNH2KDM1AMAOA

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 CYP11B1 1294/4885CYP11B2 866/4885KCNH2 1976/4885
US-20220144762-A1 METHOD FOR PREPARING AROMATIC AMINO ACID DERIVATIVE DDC, AADAT, TYR CYP11B1 1294/4885CYP11B2 866/4885KCNH2 1976/4885
US-12071396-B2 Method for preparing aromatic amino acid derivative DDC, AADAT, TYR CYP11B1 1294/4885CYP11B2 866/4885KCNH2 1976/4885

“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.