SCHEMBL4152780

SCHEMBL4152780

CS(=O)(=O)c1cccc(-c2ccc3c(c2)CCC(N2CCOCC2)C3)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 4/20 0.47
JAK3 P52333 4/20 0.47
PTK2 Q05397 3/20 0.47
MTOR P42345 2/20 0.43
PIK3CB P42338 1/20 0.43
PRKDC P78527 1/20 0.43
ATM Q13315 1/20 0.43
ATR Q13535 1/20 0.43
ATRIP Q8WXE1 1/20 0.43
PIK3CA P42336 1/20 0.41
PIK3CG P48736 1/20 0.41
HPGD P15428 1/20 0.40
ALDH1A1 P00352 1/20 0.38
ACVR1 Q04771 2/20 0.38
CYP3A4 P08684 1/20 0.37
HSD11B1 P28845 1/20 0.37
GRIA2 P42262 1/20 0.37
KCNH2 Q12809 1/20 0.36
LRRK2 Q5S007 1/20 0.36
PTGS2 P35354 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
SCHEMBL4136683 0.90 JAK3 (0.51) JAK2JAK3PTK2PIK3CBPIK3CA
SCHEMBL4130398 0.90 ACVR1 (0.39) JAK2JAK3PTK2MTORPIK3CB
SCHEMBL4127903 0.85 GRIA2 (0.40) JAK2JAK3PTK2ALDH1A1ACVR1
SCHEMBL4141084 0.81 JAK2 (0.42) JAK2JAK3PTK2PIK3CAALDH1A1
SCHEMBL4141043 0.81 KDM2B (0.38) ACVR1GRIA2
SCHEMBL4136275 0.81 GRIN2B (0.49) GRIA2GRIN2B
SCHEMBL4140906 0.79 USP30 (0.43) JAK2JAK3PTK2ALDH1A1PTGS2
SCHEMBL4144821 0.79 USP30 (0.43) JAK2JAK3PTK2LRRK2PTGS2
SCHEMBL4142661 0.79 USP30 (0.43) JAK2JAK3PTK2ALDH1A1PTGS2
SCHEMBL4140902 0.79 USP30 (0.43) JAK2JAK3PTK2ALDH1A1PTGS2

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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 US claimed

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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR HRH3, HRH4, HRH1 JAK2 1077/4885JAK3 488/4885PTK2 2784/4885

“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.