SCHEMBL6500614

SCHEMBL6500614

CC1CN(C(=O)O)CCN1S(=O)(=O)c1ccccc1S(C)(=O)=O

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.43
LMNA P02545 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
USP2 O75604 1/20 0.37
TSHR P16473 1/20 0.37
THRB P10828 1/20 0.37
ALDH1A1 P00352 1/20 0.37
RBP4 P02753 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
SCHEMBL15916184 0.86 CNR1 (0.51) CNR1L3MBTL1LMNAMEN1KMT2A
SCHEMBL15917207 0.86 CNR1 (0.51) CNR1L3MBTL1LMNAMEN1KMT2A
SCHEMBL4943200 0.83 L3MBTL1 (0.64) CNR1L3MBTL1MEN1KMT2ACYP3A4
SCHEMBL14990609 0.76 ACHE (0.55) LMNAMEN1KMT2AROCK2ROCK1
SCHEMBL14990608 0.76 ACHE (0.55) LMNAMEN1KMT2AROCK2ROCK1
SCHEMBL28626011 0.76 KMT2A (0.56) LMNAMEN1KMT2AROCK2ROCK1
SCHEMBL2832689 0.75 HCRTR1 (0.49) CNR1USP2TSHRALDH1A1
SCHEMBL2831523 0.75 HSD11B1 (0.45) CNR1USP2TSHRALDH1A1
SCHEMBL3830538 0.75 TP53 (0.40) CNR1L3MBTL1LMNATSHRALDH1A1
SCHEMBL31224057 0.75 TP53 (0.40) CNR1L3MBTL1LMNATSHRALDH1A1

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 1 patent. 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

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-20050272745-A1 Novel piperidine and piperazine derivatives CYP3A5, IL5, ABCC5 CNR1 384/4885L3MBTL1 4884/4885LMNA 3565/4885

“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.