SCHEMBL6408660

SCHEMBL6408660

Cc1ccc(NS(C)(=O)=O)cc1NC(=O)CN1CC2CCC(c3ncnc4scnc34)(C1)N2

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 1/20 0.32
APAF1 O14727 1/20 0.32
UBE2N P61088 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
KDM4E B2RXH2 3/20 0.31
ALDH1A1 P00352 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
BRAF P15056 1/20 0.31
MAPT P10636 2/20 0.30
ATM Q13315 1/20 0.30
KMT2A Q03164 2/20 0.30
LMNA P02545 1/20 0.30
MEN1 O00255 1/20 0.30
POLB P06746 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL6407652 0.88 L3MBTL1 (0.32) L3MBTL1KDM4EALDH1A1TDP1KMT2A
SCHEMBL6336269 0.86 SMN1; SMN2 (0.39) L3MBTL1ALDH1A1TDP1MAPTATM
SCHEMBL6408653 0.78 PI4KB (0.40) L3MBTL1KDM4EBRAFMAPTATM
SCHEMBL6336973 0.74 CDK2 (0.41) L3MBTL1KDM4EATMKMT2ALMNA
SCHEMBL6533769 0.70 PI4KB (0.39) ALDH1A1ATMKMT2AMEN1SMN1; SMN2
SCHEMBL6503511 0.68 HPGD (0.40) L3MBTL1ALDH1A1KMT2ALMNAPOLB
SCHEMBL6332610 0.68 PKM (0.39) L3MBTL1KDM4EALDH1A1BRAFATM
SCHEMBL6332611 0.68 PKM (0.39) L3MBTL1KDM4EALDH1A1BRAFATM
SCHEMBL6402827 0.67 PKM (0.37) L3MBTL1ALDH1A1BRAFKMT2ALMNA
SCHEMBL6407647 0.66 PI4KB (0.34) L3MBTL1KDM4EALDH1A1TDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6969713-B2 Piperidine and piperazine acetamide derivatives ASTRAZENECA AB (SE) 2005-11-29 US claimed
EP-1242427-B1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2003-08-13 EP claimed
US-20030013721-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB (SE) 2003-01-16 US claimed
US-20050272745-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB 2005-12-08 US disclosed
US-6969713-B2 Piperidine and piperazine acetamide derivatives ASTRAZENECA AB (SE) 2005-11-29 US disclosed
EP-1242427-B1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES AS P2X7 RECEPTOR ANTAGONISTS ASTRAZENECA AB (SE) 2003-08-13 EP disclosed
US-20030013721-A1 Novel piperidine and piperazine derivatives ASTRAZENECA AB (SE) 2003-01-16 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 (2 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-20050272745-A1 Novel piperidine and piperazine derivatives CYP3A5, IL5, ABCC5 PSMD14 533/4885APAF1 1189/4885UBE2N 2301/4885
US-20030013721-A1 Novel piperidine and piperazine derivatives IL5, VIP, EP300 PSMD14 997/4885APAF1 1002/4885UBE2N 2504/4885

“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.