SCHEMBL5428892

SCHEMBL5428892

Cc1cccc2c1N(C1CCN(S(=O)(=O)c3ccccc3Br)CC1)COC2

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.52
CCR1 P32246 2/20 0.41
EPHX2 P34913 4/20 0.40
TP53 P04637 1/20 0.36
MAPT P10636 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
TSHR P16473 2/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
LMNA P02545 1/20 0.35
HPGD P15428 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 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
SCHEMBL5431952 0.89 HTR6 (0.53) HTR6CCR1
SCHEMBL5421824 0.84 HTR6 (0.44) HTR6EPHX2TP53TDP1TSHR
SCHEMBL5430660 0.84 HTR6 (0.49) HTR6EPHX2TDP1LMNAALDH1A1
SCHEMBL5423536 0.83 MBTD1 (0.54) HTR6TP53MAPTTDP1TSHR
SCHEMBL3144812 0.82 HTR6 (0.77) HTR6CCR1EPHX2
SCHEMBL5427892 0.81 HTR6 (0.45) HTR6CCR1MAPTTDP1TSHR
SCHEMBL5428073 0.81 EPHX2 (0.43) HTR6CCR1EPHX2TP53MAPT
SCHEMBL5439699 0.80 ALDH1A1 (0.55) HTR6TP53MAPTTDP1TSHR
SCHEMBL5430905 0.80 PKM (0.50) HTR6CCR1TP53TDP1TSHR
SCHEMBL5781991 0.79 SMN1; SMN2 (0.50) HTR6TP53MAPTTDP1TSHR

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-20070032482-A1 Benzoxazinone-derived sulfonamide compounds, their preparation and use as medicaments LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-02-08 US claimed
US-20070032482-A1 Benzoxazinone-derived sulfonamide compounds, their preparation and use as medicaments LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2007-02-08 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-20070032482-A1 Benzoxazinone-derived sulfonamide compounds, their preparation and use as medicaments HTR6, HTR5A, P2RX6 HTR6 1/4885CCR1 4779/4885EPHX2 2092/4885

“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.