SCHEMBL926563

SCHEMBL926563

COC(=O)[C@@H]1Cc2ccccc2N1S(=O)(=O)c1ccc(OC(C)(C)C)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.48
ALDH1A1 P00352 2/20 0.48
LMNA P02545 2/20 0.46
POLB P06746 2/20 0.44
GAA P10253 2/20 0.44
TSHR P16473 2/20 0.44
MEN1 O00255 1/20 0.44
MAPT P10636 1/20 0.44
MAPK1 P28482 1/20 0.44
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
PTGER3 P43115 1/20 0.43
MMP2 P08253 2/20 0.43
ANPEP P15144 2/20 0.43
CRHBP P24387 1/20 0.42
CRHR2 Q13324 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
ESR1 P03372 1/20 0.41
MMP8 P22894 3/20 0.41
MMP1 P03956 2/20 0.41

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
SCHEMBL926644 0.89 NPSR1 (0.50) NPSR1ALDH1A1LMNAPOLBGAA
SCHEMBL644486 0.89 ALDH1A1 (0.52) NPSR1ALDH1A1LMNAPOLBGAA
SCHEMBL926646 0.88 NPSR1 (0.49) NPSR1ALDH1A1LMNAPOLBGAA
SCHEMBL3588564 0.87 LMNA (0.47) NPSR1ALDH1A1LMNAPOLBGAA
SCHEMBL2519677 0.85 ESR1 (0.56) NPSR1ALDH1A1LMNAPOLBGAA
SCHEMBL2519672 0.85 ESR1 (0.56) NPSR1ALDH1A1LMNAPOLBGAA
SCHEMBL2519245 0.82 ALDH1A1 (0.53) NPSR1ALDH1A1MEN1MAPK1KMT2A
SCHEMBL2519247 0.82 ALDH1A1 (0.53) NPSR1ALDH1A1MEN1MAPK1KMT2A
SCHEMBL4843221 0.81 MMP8 (0.52) NPSR1ALDH1A1LMNAPOLBGAA
SCHEMBL644139 0.79 ALDH1A1 (0.47) NPSR1ALDH1A1LMNAPOLBGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7872021-B2 LXR receptor modulators LABORATORIES FOURNIER S.A. (FR) 2011-01-18 US disclosed
US-20070099960-A1 LXR receptor modulators LABORATOIRES FOURNIER S.A. (FR) 2007-05-03 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-20070099960-A1 LXR receptor modulators NR1H2, NR1H3, PPARD NPSR1 297/4885ALDH1A1 2845/4885LMNA 1809/4885

“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.