SCHEMBL6095827

SCHEMBL6095827

CC(C)CCC(N1CCCC(=Cc2ccccc2)C1)S(=O)(=O)c1ccccc1

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.35
KDM4E B2RXH2 1/20 0.33
S1PR1 P21453 1/20 0.32
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP1A2 P05177 1/20 0.31
F3 P13726 1/20 0.31
SRD5A2 P31213 1/20 0.31
CYP2D6 P10635 2/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A3 Q01959 1/20 0.30
TSHR P16473 2/20 0.30
USP2 O75604 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
RCE1 Q9Y256 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM1 P11229 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
SCHEMBL6096487 0.82 KDM4E (0.39) RORCKDM4EALDH1A1GAAKMT2A
SCHEMBL6097283 0.76 MEN1 (0.46) KDM4EALDH1A1GAAKMT2ATSHR
SCHEMBL6097980 0.76 KDM4E (0.36) RORCKDM4EALDH1A1GAAKMT2A
SCHEMBL6099117 0.74 HSD11B1 (0.40) RORCKDM4EALDH1A1GAAKMT2A
SCHEMBL6097882 0.73 RORC (0.34) RORCKDM4EALDH1A1GAAKMT2A
SCHEMBL6097505 0.73 RORC (0.34) RORCKDM4EALDH1A1GAAKMT2A
SCHEMBL6096318 0.72 KDM4E (0.35) RORCKDM4EALDH1A1GAAKMT2A
SCHEMBL6095467 0.72 RORC (0.46) RORCKDM4EALDH1A1GAAKMT2A
SCHEMBL6097057 0.70 RORC (0.41) RORCKDM4ETSHRCYP2C19
SCHEMBL6098125 0.70 FABP6 (0.36) RORCKDM4EALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7101892-B2 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. 2006-09-05 US disclosed
US-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands MERCK SHARP & DOHME LTD. (GB) 2004-11-18 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-20040229864-A1 Sulfone derivatives as 5-HT7 receptor ligands HTR7, HTR2C, HTR1A RORC 669/4885KDM4E 2306/4885S1PR1 221/4885

“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.