SCHEMBL4375810

SCHEMBL4375810

CS(=O)(=O)C1CCN(CCC[O])C1

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.34
HTR7 P34969 2/20 0.34
KCNH2 Q12809 1/20 0.34
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR4 P22455 1/20 0.33
FGFR3 P22607 1/20 0.33
KDR P35968 1/20 0.33
FLT3 P36888 1/20 0.33
HTR1A P08908 1/20 0.32
DRD2 P14416 1/20 0.32
LTA4H P09960 1/20 0.30
EBP Q15125 1/20 0.30
SIGMAR1 Q99720 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
SCHEMBL4375813 0.84 HTR2A (0.33) HTR2AHTR7KCNH2FGFR1FGFR2
SCHEMBL22521632 0.83 GNAI3 (0.49) EBPSIGMAR1
SCHEMBL806006 0.81 DRD2 (0.40) DRD2SIGMAR1
SCHEMBL14116869 0.81 FGFR1 (0.36) HTR2AHTR7KCNH2FGFR1FGFR2
SCHEMBL438485 0.79 RORC (0.37) HTR7SIGMAR1
SCHEMBL15998447 0.77 SMN1; SMN2 (0.38) HTR2ALTA4H
SCHEMBL2115304 0.77 SIGMAR1 (0.41) HTR7KCNH2HTR1ASIGMAR1
SCHEMBL10284374 0.75 RORC (0.31) HTR7
SCHEMBL22922810 0.73 KEAP1 (0.42) HTR2AKCNH2LTA4HSIGMAR1
SCHEMBL8265415 0.73 ALDH1A1 (0.38) LTA4H

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2780026-B1 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME (US) 2019-10-23 EP disclosed
US-9328138-B2 HCV NS3 protease inhibitors MSD ITALIA S.R.L. (IT) 2016-05-03 US disclosed
US-20140296136-A1 HCV NS3 PROTEASE INHIBITORS MERCK SHARP & DOHME LLC 2014-10-02 US disclosed
US-7504416-B2 4-substituted quinolines as antitumor agents ASTRAZENECA AB (SE) 2009-03-17 US disclosed
US-20080027054-A1 4-Substituted quinolines as antitumor agents ASTRAZENECA AB 2008-01-31 US disclosed
US-7253184-B2 4-Substituted quinolines as antitumor agents ASTRAZENECA AB (SE) 2007-08-07 US disclosed
US-20050101630-A1 4-Substituted quinolines as antitumor agents ASTRAZENECA AB (SE) 2005-05-12 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 (3 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-20080027054-A1 4-Substituted quinolines as antitumor agents CCNY, TPD52L2, H1-10 HTR2A 2784/4885HTR7 1963/4885KCNH2 1540/4885
US-20140296136-A1 HCV NS3 PROTEASE INHIBITORS HAVCR2, GTF3C3, CTSC HTR2A 3764/4885HTR7 3827/4885KCNH2 4405/4885
US-20050101630-A1 4-Substituted quinolines as antitumor agents NQO2, TPD52L2, MLX HTR2A 3305/4885HTR7 3167/4885KCNH2 1991/4885

“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.