SCHEMBL30700705

SCHEMBL30700705

CS(=O)(=O)c1cc(C(F)(F)F)ccc1Br

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 2/20 0.43
FEN1 P39748 2/20 0.43
EPHX2 P34913 1/20 0.41
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
KMT2A Q03164 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
ERAP1 Q9NZ08 1/20 0.39
ADRA1A P35348 1/20 0.39
KIF11 P52732 3/20 0.39
PTGS2 P35354 2/20 0.38
ABCB11 O95342 1/20 0.37
TAS2R14 Q9NYV8 1/20 0.37
POLB P06746 1/20 0.37
CNR2 P34972 1/20 0.36
PDE2A O00408 1/20 0.36
NR1I2 O75469 1/20 0.36
CACNA1B Q00975 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
SCHEMBL15009785 1.00 ALOX5AP (0.43) ALOX5APFEN1EPHX2MEN1ALDH1A1
SCHEMBL30553370 0.89 EPHX2 (0.39) ALOX5APFEN1EPHX2MEN1ALDH1A1
SCHEMBL14684308 0.87 ADRA1A (0.43) ALOX5APFEN1EPHX2MEN1ALDH1A1
SCHEMBL27872324 0.85 EPHX2 (0.43) ALOX5APFEN1EPHX2MEN1ALDH1A1
SCHEMBL30214832 0.83 KIF11 (0.47) ALOX5APFEN1EPHX2MEN1ALDH1A1
SCHEMBL2182720 0.83 KIF11 (0.47) ALOX5APFEN1EPHX2MEN1ALDH1A1
SCHEMBL28230701 0.82 ALOX5AP (0.46) ALOX5APFEN1MEN1ALDH1A1TSHR
SCHEMBL17927016 0.82 DDR1 (0.43) EPHX2
SCHEMBL30214735 0.81 ALDH1A1 (0.43) ALOX5APFEN1EPHX2MEN1ALDH1A1
SCHEMBL310121 0.81 ALDH1A1 (0.43) ALOX5APFEN1EPHX2MEN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250099448-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2025-03-27 US disclosed
CN-119301113-A Novel heterocyclic carbonyl cyclic compounds as MAGL inhibitors 豪夫迈·罗氏有限公司 2025-01-10 CN disclosed
US-20240383904-A1 HETEROCYCLIC COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2024-11-21 US disclosed
US-20240262806-A1 INHIBITORS OF NLRP3 PCT THERAPEUTICS, INC. (US) 2024-08-08 US disclosed
CN-118302417-A NLRP3 inhibitors PTC医疗公司 2024-07-05 CN disclosed
WO-2023247670-A1 NEW HETEROCYCLIC-CARBONYL-CYCLIC COMPOUNDS AS MAGL INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2023-12-28 WO 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-20240262806-A1 INHIBITORS OF NLRP3 NLRP3, NOD1, NLRP1 ALOX5AP 1247/4885FEN1 4354/4885EPHX2 2370/4885
US-20240383904-A1 HETEROCYCLIC COMPOUNDS MAGI3, MAG, MAGT1 ALOX5AP 2101/4885FEN1 3485/4885EPHX2 256/4885
US-20250099448-A1 HETEROCYCLIC COMPOUNDS OPRM1, CYP1A1, CYP3A4 ALOX5AP 2464/4885FEN1 4564/4885EPHX2 292/4885

“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.