SCHEMBL5763369

SCHEMBL5763369

CC(C)(C)OC(=O)N1CCN(c2cccc3c(S(=O)(=O)c4ccccc4)ccnc23)CC1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.51
ACHE P22303 2/20 0.47
KIT P10721 1/20 0.46
CKS1B P61024 2/20 0.45
SKP1 P63208 2/20 0.45
SKP2 Q13309 2/20 0.45
GBA1 P04062 2/20 0.44
BACE1 P56817 3/20 0.43
GPR119 Q8TDV5 4/20 0.42
HTR6 P50406 2/20 0.42
CHRNA7 P36544 1/20 0.42
POLB P06746 1/20 0.41
SMARCA2 P51531 1/20 0.41
SMARCA4 P51532 1/20 0.41
PBRM1 Q86U86 1/20 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
SCHEMBL3831589 0.81 PIK3CA (0.51) PIK3CACKS1BSKP1SKP2BACE1
SCHEMBL5761659 0.80 PIK3CA (0.49) PIK3CAACHEKITCKS1BSKP1
SCHEMBL5763597 0.80 HTR6 (0.67) PIK3CAACHEKITCKS1BSKP1
SCHEMBL2197307 0.79 HTR2A (0.63) PIK3CAACHEKITCKS1BSKP1
SCHEMBL5203242 0.79 HTR6 (0.52) PIK3CAACHECKS1BSKP1SKP2
SCHEMBL6581755 0.79 HTR6 (0.64) PIK3CACKS1BSKP1SKP2GBA1
SCHEMBL5202405 0.79 HTR6 (0.70) PIK3CAKITCKS1BSKP1SKP2
SCHEMBL5763068 0.79 HTR6 (0.64) HTR6
Hydrochloric Acid SCHEMBL5761759 0.78 HTR6 (0.62) HTR6
SCHEMBL2195197 0.76 HTR2A (0.59) PIK3CAACHEKITCKS1BSKP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1497291-B1 QUINOLINE AND AZA-INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 LIGANDS GLAXO GROUP LTD (GB) 2006-11-22 EP disclosed
US-20050124626-A1 Novel compounds GLAXO GROUP LIMITED (GB) 2005-06-09 US disclosed
EP-1497291-A2 QUINOLINE AND AZA-INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 LIGANDS GLAXO GROUP LIMITED (GB) 2005-01-19 EP disclosed
WO-2003080608-A2 QUINOLINE AND AZA-INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 LIGANDS GLAXO GROUP LIMITED (GB) 2003-10-02 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-20050124626-A1 Novel compounds AANAT, INMT, CHRNA5 PIK3CA 1616/4885ACHE 55/4885KIT 2558/4885

“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.