SCHEMBL3372237

SCHEMBL3372237

COc1cccc(-c2nc(C)c(CO)s2)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.55
SMN1; SMN2 Q16637 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
NFKB1 P19838 1/20 0.53
RAB9A P51151 1/20 0.53
NFKB2 Q00653 1/20 0.53
RELA Q04206 1/20 0.53
LMNA P02545 4/20 0.49
TP53 P04637 2/20 0.49
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
USP2 O75604 2/20 0.47
HSD17B10 Q99714 2/20 0.47
HPGD P15428 1/20 0.47
TRPM8 Q7Z2W7 1/20 0.46
PTGDR2 Q9Y5Y4 2/20 0.44
TSHR P16473 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43

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
SCHEMBL13462298 0.84 MAPT (0.51) MAPTSMN1; SMN2TDP1NFKB1RAB9A
SCHEMBL28295525 0.82 ALOX5 (0.60) MAPTLMNATP53PTGDR2
SCHEMBL12875924 0.82 LMNA (0.54) MAPTSMN1; SMN2RAB9ALMNATP53
SCHEMBL2881560 0.79 CDC7 (0.63) MAPTSMN1; SMN2LMNAKDM4EALDH1A1
SCHEMBL3077683 0.79 SMN1; SMN2 (0.56) MAPTSMN1; SMN2RAB9ALMNATP53
SCHEMBL4151388 0.78 LMNA (0.42) MAPTSMN1; SMN2RAB9ALMNATP53
SCHEMBL1198943 0.77 ALDH1A1 (0.63) MAPTSMN1; SMN2RAB9ALMNAALDH1A1
SCHEMBL3436700 0.77 CYP1A1 (0.51) MAPTSMN1; SMN2NFKB1RAB9ANFKB2
SCHEMBL16806034 0.75 ALOX5 (0.72) MAPTSMN1; SMN2TDP1NFKB1RAB9A
SCHEMBL2764145 0.74 MAPT (0.54) MAPTLMNATP53KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1537091-B1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMMA AGONISTS HOFFMANN LA ROCHE (CH) 2010-10-06 EP disclosed
EP-1537091-A1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMMA AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2005-06-08 EP disclosed
US-6809110-B2 NONINSULIN DEPENDENT DIABETES; SUCH AS 2-ETHOXY-3-(4-(2-(5-METHYL-2-PHENYL-THIAZOL-4-YL)-ETHOXY)-BENZO(B)THIOPHEN-7-YL)-PROPIONIC ACID HOFFMANN-LA ROCHE INC. 2004-10-26 US disclosed
US-20040110807-A1 Thiazole derivatives HOFFMANN-LA ROCHE INC. 2004-06-10 US disclosed
WO-2004020420-A1 NOVEL 2-ARYLTHIAZOLE COMPOUNDS AS PPARALPHA AND PPARGAMA AGONISTS F.HOFFMANN-LA ROCHE AG (CH) 2004-03-11 WO 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-20040110807-A1 Thiazole derivatives SLC5A1, GPR119, INSR MAPT 4327/4885SMN1; SMN2 2045/4885TDP1 1466/4885

“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.