SCHEMBL6407652

SCHEMBL6407652

Cc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1NC(=O)CN1CC2CCC(c3ncnc4scnc34)(C1)N2

nearest known ligand 0.34

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.32
KMT2A Q03164 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
CTSD P07339 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
SCHEMBL6408660 0.88 PSMD14 (0.32) L3MBTL1KMT2AKDM4EALDH1A1TDP1
SCHEMBL6336269 0.85 SMN1; SMN2 (0.39) L3MBTL1KMT2AALDH1A1TDP1
SCHEMBL6407647 0.78 PI4KB (0.34) L3MBTL1KMT2AKDM4EALDH1A1TDP1
SCHEMBL6407500 0.73 L3MBTL1 (0.41) L3MBTL1KMT2AKDM4EALDH1A1TDP1
SCHEMBL6336973 0.72 CDK2 (0.41) L3MBTL1KMT2AKDM4E
SCHEMBL6405533 0.69 PKM (0.37) L3MBTL1KMT2AKDM4EALDH1A1
SCHEMBL6405526 0.69 PKM (0.37) L3MBTL1KMT2AKDM4EALDH1A1
SCHEMBL6503511 0.68 HPGD (0.40) L3MBTL1KMT2AALDH1A1
SCHEMBL6410153 0.66 KDM4E (0.43) L3MBTL1KMT2AKDM4EALDH1A1TDP1
SCHEMBL6408653 0.66 PI4KB (0.40) L3MBTL1KMT2AKDM4E

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
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 L3MBTL1 4884/4885KMT2A 2331/4885KDM4E 1104/4885
US-20030013721-A1 Novel piperidine and piperazine derivatives IL5, VIP, EP300 L3MBTL1 4881/4885KMT2A 2632/4885KDM4E 1566/4885

“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.