SCHEMBL6427276

SCHEMBL6427276

O=C(CC1SC(NC2CC3C=CC2C3)=NC1=O)Nc1cccc(C(=O)O)c1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.56
L3MBTL1 Q9Y468 4/20 0.48
POLB P06746 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
MAPT P10636 1/20 0.48
ALDH1A1 P00352 3/20 0.47
KMT2A Q03164 5/20 0.43
GAA P10253 2/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 3/20 0.40
RAB9A P51151 3/20 0.38
NPC1 O15118 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36

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
SCHEMBL6429151 0.90 CYP2C19 (0.41) CYP2C19L3MBTL1POLBTDP1MAPT
SCHEMBL6508258 0.83 MAP2K1 (0.43) CYP2C19L3MBTL1POLBMAPTALDH1A1
SCHEMBL1606025 0.82 MAPT (0.46) L3MBTL1POLBMAPTALDH1A1KMT2A
SCHEMBL6427444 0.81 CYP2C19 (0.41) CYP2C19L3MBTL1POLBMAPTALDH1A1
SCHEMBL6426946 0.79 P2RX7 (0.44) CYP2C19L3MBTL1POLBMAPTALDH1A1
SCHEMBL6427367 0.79 MAPT (0.37) TDP1MAPTALDH1A1GAAKDM4E
SCHEMBL6427842 0.79 ALDH1A1 (0.56) CYP2C19L3MBTL1POLBALDH1A1KMT2A
SCHEMBL6426304 0.79 EPHX2 (0.34) L3MBTL1POLBTDP1ALDH1A1KMT2A
SCHEMBL6502404 0.78 ALDH1A1 (0.49) CYP2C19MAPTALDH1A1KMT2AGAA
SCHEMBL1606042 0.78 POLB (0.44) L3MBTL1POLBTDP1ALDH1A1KMT2A

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-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 US claimed
WO-2005075471-A2 THIAZOL-COMPOUNDS AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS BIOVITRUM AB (SE) 2005-08-18 WO claimed
US-20050239853-A1 New compounds BIOVITRUM AB (SE) 2005-10-27 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-20050239853-A1 New compounds HSD11B1, CYP11B1, HSD3B1 CYP2C19 89/4885L3MBTL1 4470/4885POLB 1038/4885

“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.