SCHEMBL24549313

SCHEMBL24549313

COc1ccc(S(=O)(=O)NC(C)(C)C)cn1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.45
MAPT P10636 2/20 0.45
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
USP2 O75604 1/20 0.45
SLC22A12 Q96S37 1/20 0.45
LMNA P02545 3/20 0.44
PABPC1 P11940 2/20 0.44
KDM4E B2RXH2 2/20 0.42
NPC1 O15118 1/20 0.42
HPGD P15428 1/20 0.42
RAB9A P51151 1/20 0.42
KIT P10721 1/20 0.42
TSHR P16473 1/20 0.42
HTT P42858 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2C9 P11712 1/20 0.42
MAPK1 P28482 1/20 0.42

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
SCHEMBL10153783 0.81 MEN1 (0.48) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL958145 0.80 KCNH2 (0.47) SMN1; SMN2MAPTMEN1KMT2AUSP2
SCHEMBL2568007 0.77 KDM4E (0.55) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL2566837 0.77 ALDH1A1 (0.59) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL23092657 0.77 KDM4E (0.53) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL24549326 0.77 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL29715407 0.77 KDM4E (0.53) ALDH1A1SMN1; SMN2MAPTMEN1KMT2A
SCHEMBL117602 0.76 ALDH1A1 (0.65) ALDH1A1SMN1; SMN2KMT2ALMNAL3MBTL1
SCHEMBL1688213 0.75 KCNH2 (0.56) ALDH1A1SMN1; SMN2MEN1KMT2AUSP2
SCHEMBL10769588 0.74 CA1 (0.61) ALDH1A1SMN1; SMN2MAPTLMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220194945-A1 Imidazolopyridine Compounds For IRE1 Inhibition Optikira, LLC 2022-06-23 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-20220194945-A1 Imidazolopyridine Compounds For IRE1 Inhibition XBP1, ERN2, ERN1 ALDH1A1 2541/4885SMN1; SMN2 88/4885MAPT 1360/4885

“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.