SCHEMBL6410153

SCHEMBL6410153

Cc1ccc(N(S(C)(=O)=O)S(C)(=O)=O)cc1NC(=O)CN1CC2CCC(C1)N2C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 3/20 0.43
PKM P14618 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.40
MEN1 O00255 5/20 0.39
KMT2A Q03164 5/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
CTSD P07339 2/20 0.39
MAPT P10636 2/20 0.39
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.38
ANXA2 P07355 1/20 0.37
S100A10 P60903 1/20 0.37
LMNA P02545 1/20 0.36
DRD4 P21917 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6407500 0.84 L3MBTL1 (0.41) KDM4EALDH1A1PKML3MBTL1MEN1
SCHEMBL6344365 0.78 MEN1 (0.57) ALDH1A1L3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL6407647 0.77 PI4KB (0.34) KDM4EALDH1A1PKML3MBTL1MEN1
SCHEMBL6408514 0.77 KDM4E (0.36) KDM4EALDH1A1PKML3MBTL1MEN1
SCHEMBL6403530 0.73 ALDH1A1 (0.49) KDM4EALDH1A1KMT2ASMN1; SMN2CTSD
SCHEMBL6410963 0.72 RORC (0.37) KDM4EALDH1A1PKML3MBTL1MEN1
SCHEMBL6410968 0.72 RORC (0.37) KDM4EALDH1A1PKML3MBTL1MEN1
SCHEMBL6405526 0.71 PKM (0.37) KDM4EALDH1A1PKML3MBTL1MEN1
SCHEMBL6405533 0.71 PKM (0.37) KDM4EALDH1A1PKML3MBTL1MEN1
SCHEMBL6335320 0.70 KMT2A (0.53) KDM4EALDH1A1MEN1KMT2ASMN1; SMN2

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 6 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
EP-1242427-A1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES AstraZeneca AB (SE) 2002-09-25 EP disclosed
WO-2001046200-A1 NOVEL PIPERIDINE AND PIPERAZINE DERIVATIVES ASTRAZENECA AB (SE) 2001-06-28 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 (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 KDM4E 1104/4885ALDH1A1 187/4885PKM 658/4885
US-20030013721-A1 Novel piperidine and piperazine derivatives IL5, VIP, EP300 KDM4E 1566/4885ALDH1A1 68/4885PKM 658/4885

“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.