SCHEMBL1308951

SCHEMBL1308951

[C-]#[N+]C(c1cccnc1)S(=O)(=O)c1ccc(C)cc1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
LMNA P02545 2/20 0.44
MAPK1 P28482 1/20 0.44
POLB P06746 1/20 0.44
KDM4E B2RXH2 1/20 0.43
EGFR P00533 1/20 0.43
PTGS2 P35354 1/20 0.43
KMT2A Q03164 2/20 0.43
GAA P10253 1/20 0.43
TBXAS1 P24557 2/20 0.42
MEN1 O00255 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MAPT P10636 1/20 0.41
NPY2R P49146 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL29952726 1.00 ALDH1A1 (0.49) ALDH1A1LMNAMAPK1POLBKDM4E
SCHEMBL29954094 0.82 KMT2A (0.43) ALDH1A1LMNAKDM4EPTGS2KMT2A
SCHEMBL408195 0.82 NPY2R (0.47) ALDH1A1LMNAMAPK1KDM4EKMT2A
SCHEMBL29956006 0.80 GAA (0.45) ALDH1A1LMNAKDM4EGAAMAPT
SCHEMBL5837673 0.78 HTT (0.41) ALDH1A1MAPK1KMT2AGAATDP1
SCHEMBL17446873 0.77 ALDH1A1 (0.49) ALDH1A1LMNAMAPK1POLBKDM4E
SCHEMBL2733040 0.75 ALDH1A1 (0.50) ALDH1A1LMNAMAPK1POLBKDM4E
SCHEMBL5851624 0.74 MAPT (0.44) ALDH1A1LMNAKMT2AGAAMEN1
SCHEMBL4833791 0.74 CES2 (0.37) ALDH1A1NPY2R
SCHEMBL29952039 0.74 MAPT (0.44) ALDH1A1LMNAKMT2AGAAMEN1

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
CN-111936496-B Heterocyclic compounds useful as medicaments 马萨里克大学 2023-12-29 CN disclosed
US-8053457-B2 3-imidazolyl-indoles for the treatment of proliferative diseases NOVARTIS AG (CH) 2011-11-08 US disclosed
US-20100125064-A1 3-Imidazolyl-Indoles for the Treatment of Proliferative Diseases NOVARTIS AG (CH) 2010-05-20 US disclosed
EP-2142535-A2 3-IMIDAZOLYL-INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES Novartis Ag (CH) 2010-01-13 EP disclosed
WO-2008119741-A2 3-IMIDAZOLYL-INDOLES FOR THE TREATMENT OF PROLIFERATIVE DISEASES NOVARTIS AG (CH) 2008-10-09 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-20100125064-A1 3-Imidazolyl-Indoles for the Treatment of Proliferative Diseases MDM4, TP53, MDM2 ALDH1A1 2589/4885LMNA 2574/4885MAPK1 1183/4885

“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.