SCHEMBL4544775

SCHEMBL4544775

CN(Cc1ccco1)C(=O)C(Cc1ccccc1)NS(=O)(=O)c1ccc2c(c1)CCC(=O)N2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
OGT O15294 8/20 1.00
MAPT P10636 4/20 1.00
ALDH1A1 P00352 3/20 1.00
LMNA P02545 1/20 0.73
TSHR P16473 1/20 0.73
MEN1 O00255 1/20 0.63
CYP3A4 P08684 1/20 0.63
CYP2D6 P10635 1/20 0.63
KMT2A Q03164 1/20 0.63
THRB P10828 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
TP53 P04637 1/20 0.60

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
SCHEMBL16487672 0.86 OGT (0.75) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487643 0.84 LMNA (1.00) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487669 0.83 OGT (0.77) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487627 0.81 LMNA (0.80) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487629 0.81 OGT (0.82) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487631 0.80 LMNA (0.70) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487619 0.80 LMNA (0.75) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487592 0.80 MEN1 (0.75) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487681 0.80 LMNA (0.82) OGTMAPTALDH1A1LMNATSHR
SCHEMBL16487676 0.79 MEN1 (0.77) OGTMAPTALDH1A1LMNATSHR

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
US-8957075-B2 O-GlcNAc transferase inhibitors and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-02-17 US disclosed
US-8957075-B2 O-GlcNAc transferase inhibitors and uses thereof PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-02-17 US disclosed
US-20120108605-A1 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-05-03 US disclosed
US-20120108605-A1 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2012-05-03 US disclosed
WO-2010141074-A2 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2010-12-09 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-20120108605-A1 O-GLCNAC TRANSFERASE INHIBITORS AND USES THEREOF OGA, OGT, UGGT1 OGT 2/4885MAPT 759/4885ALDH1A1 1153/4885

“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.