SCHEMBL6098038

SCHEMBL6098038

CCCOC1CCCN(C(CCC(C)C)S(=O)(=O)c2ccccc2)C1

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 1/20 0.38
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
CYP2C19 P33261 1/20 0.35
DGAT2 Q96PD7 1/20 0.35
FFAR2 O15552 1/20 0.35
RORC P51449 4/20 0.34
KMT2A Q03164 2/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A3 Q01959 1/20 0.34
CYP3A4 P08684 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
MEN1 O00255 1/20 0.33
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL6099133 0.87 CHRM2 (0.39) LMNAMAPK1RORCCHRM2CHRM1
SCHEMBL6097057 0.87 RORC (0.41) CYP2C19DGAT2FFAR2RORC
SCHEMBL6095467 0.80 RORC (0.46) CYP2C19RORCKMT2AMEN1
SCHEMBL6097247 0.79 CYP2C19 (0.38) LMNACYP2C19RORCKMT2ACHRM2
SCHEMBL6098988 0.78 CYP2C19 (0.41) LMNACYP2C19KMT2ASLC6A2SLC6A3
SCHEMBL6095436 0.78 CYP2C19 (0.41) CYP2C19RORCKMT2ACYP3A4CYP2D6
SCHEMBL6097882 0.78 RORC (0.34) LMNACYP2C19RORCKMT2ACHRM2
SCHEMBL6097505 0.78 RORC (0.34) LMNACYP2C19RORCKMT2ACHRM2
SCHEMBL6098125 0.78 FABP6 (0.36) RORC
Hydrochloric Acid SCHEMBL6097193 0.77 CYP2C19 (0.40) CYP2C19RORCKMT2ACYP3A4CYP2D6

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 TAAR1 28/4885LMNA 3190/4885MAPK1 1879/4885

“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.