SCHEMBL6095708

SCHEMBL6095708

CON=C(C)C1CCCN(C(CCC(C)C)S(=O)(=O)c2ccccc2)C1

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.37
HTR7 P34969 2/20 0.36
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
HTR2A P28223 1/20 0.36
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
USP2 O75604 1/20 0.35
GAA P10253 1/20 0.35

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
SCHEMBL6097394 0.84 CYP2C19 (0.39) CYP2C19HSD17B10KMT2AALDH1A1USP2
SCHEMBL6099714 0.82 KMT2A (0.50) CYP2C19KMT2AALDH1A1
SCHEMBL6097057 0.80 RORC (0.41) CYP2C19HSD17B10KDM4E
SCHEMBL6098988 0.80 CYP2C19 (0.41) CYP2C19HSD17B10KMT2AKDM4EALDH1A1
SCHEMBL6095467 0.80 RORC (0.46) CYP2C19HSD17B10MAPTKMT2AKDM4E
SCHEMBL6097919 0.79 CYP2C19 (0.39) CYP2C19HSD17B10KMT2AALDH1A1USP2
SCHEMBL6095436 0.78 CYP2C19 (0.41) CYP2C19MAPTKMT2AALDH1A1GAA
SCHEMBL6097159 0.77 CYP2D6 (0.35) CYP2C19HSD17B10MAPTKMT2AKDM4E
Hydrochloric Acid SCHEMBL6097193 0.77 CYP2C19 (0.40) CYP2C19MAPTKMT2AALDH1A1GAA
SCHEMBL6097247 0.76 CYP2C19 (0.38) CYP2C19HTR7KMT2AALDH1A1

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 CYP2C19 446/4885HSD17B10 2214/4885HTR7 1/4885

“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.