SCHEMBL449608

SCHEMBL449608

O=S(=O)(NCCO)c1cc(Nc2c(Cl)cc(C(F)(F)F)cc2Cl)ccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GSTO1 P78417 5/20 0.58
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALOX5AP P20292 2/20 0.42
FEN1 P39748 2/20 0.42
ALDH1A1 P00352 3/20 0.41
CNR1 P21554 2/20 0.41
CNR2 P34972 2/20 0.41
PIK3CD O00329 2/20 0.40
PIK3CG P48736 2/20 0.40
MCL1 Q07820 1/20 0.40
GAA P10253 1/20 0.40
THRB P10828 1/20 0.40
PIK3C2A O00443 1/20 0.39
PIK3C2B O00750 1/20 0.39
PIK3CA P42336 1/20 0.39
PIK3CB P42338 1/20 0.39
PI4KA P42356 1/20 0.39
PRKDC P78527 1/20 0.39

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
SCHEMBL453503 0.88 GSTO1 (0.63) GSTO1MAPTCNR1CNR2PIK3CD
SCHEMBL448977 0.84 CYP2C19 (0.46) GSTO1MAPTMEN1KMT2AALOX5AP
SCHEMBL449207 0.81 MCL1 (0.43) GSTO1ALOX5APFEN1ALDH1A1CNR2
SCHEMBL30794636 0.81 MCL1 (0.43) GSTO1ALOX5APFEN1ALDH1A1CNR2
SCHEMBL3717918 0.73 GAA (0.67) GSTO1MAPTALDH1A1PIK3CDPIK3CG
SCHEMBL30795667 0.72 GPR52 (0.55) MAPTALDH1A1
SCHEMBL1578844 0.72 GPR52 (0.55) MAPTALDH1A1
SCHEMBL2511779 0.71 GLA (0.43) CNR1CNR2LMNAGLACDK1
SCHEMBL30795090 0.71 LMNA (0.40) ALDH1A1MCL1GAALMNA
SCHEMBL448018 0.71 LMNA (0.40) ALDH1A1MCL1GAALMNA

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 278 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2231594-B1 POTASSIUM ION CHANNEL MODULATORS AND USES THEREOF UNIV RAMOT (IL) 2013-03-27 EP claimed
US-20120065270-A1 POTASSIUM ION CHANNEL MODULATORS AND USES THEREOF RAMOT AT TEL AVIV UNIVERSITY LTD. (IL) 2012-03-15 US claimed
EP-2231594-A2 POTASSIUM ION CHANNEL MODULATORS AND USES THEREOF Ramot at Tel-Aviv University Ltd (IL) 2010-09-29 EP claimed
WO-2009071947-A2 POTASSIUM ION CHANNEL MODULATORS & USES THEREOF LECTUS THERAPEUTICS LIMITED (GB) 2009-06-11 WO claimed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US claimed
US-4473578-A ACID, ESTER OR SALT DERIVATIVES OF MERCAPTO CARBAPENEMS BEECHAM GROUP LIMITED (GB) 1984-09-25 US claimed
US-4454069-A Clavulanic acid salts and their preparation from the tertiary butyl amine salt BEECHAM GROUP LIMITED (GB) 1984-06-12 US claimed
US-4421760-A β-Lactam antibiotic, its preparation and use BEECHAM GROUP LIMITED (GB) 1983-12-20 US claimed
US-20240131180-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2024-04-25 US disclosed
EP-4025253-B1 DRUG ANTIBODY CONJUGATES PHARMA MAR SA (ES) 2024-03-20 EP disclosed
US-20230218774-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2023-07-13 US disclosed
WO-2023085402-A1 PEPTIDE HAVING INHIBITORY ACTIVITY ON FORMATION OF LEUKOCYTE EXTRACELLULAR TRAPS 平橋 淳一 2023-05-19 WO disclosed
EP-4138923-A1 DRUG ANTIBODY CONJUGATES Pharma Mar, S.A. (ES) 2023-03-01 EP disclosed
US-20230012681-A1 ANTIBODY DRUG CONJUGATES COMPRISING ECTEINASCIDIN DERIVATIVES PHARMA MAR, S.A. (ES) 2023-01-19 US disclosed
EP-0060077-A1 Beta-lactam antibiotics, their preparation and use BEECHAM GROUP PLC (GB) 1982-09-15 EP disclosed
EP-0057565-A1 Beta-lactam antibiotics, their preparation and use BEECHAM GROUP PLC (GB) 1982-08-11 EP disclosed
EP-0050927-A1 The preparation of beta-lactam antibiotics BEECHAM GROUP PLC (GB) 1982-05-05 EP disclosed
EP-0044142-A1 Process for the preparation of beta-lactam antibiotics BEECHAM GROUP PLC (GB) 1982-01-20 EP disclosed
EP-0044170-A1 Beta-lactam antibiotics, their preparation and use BEECHAM GROUP PLC (GB) 1982-01-20 EP disclosed
EP-0043197-A1 Beta-Lactam antibiotic, its preparation and use BEECHAM GROUP PLC (GB) 1982-01-06 EP 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 (4 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-20240131180-A1 DRUG ANTIBODY CONJUGATES STT3B, STT3A, TTL GSTO1 975/4885MAPT 8/4885MEN1 3189/4885
US-20120065270-A1 POTASSIUM ION CHANNEL MODULATORS AND USES THEREOF KCNN3, SCN2B, SCN1B GSTO1 1842/4885MAPT 4830/4885MEN1 3291/4885
US-20230012681-A1 ANTIBODY DRUG CONJUGATES COMPRISING ECTEINASCIDIN DERIVATIVES HDGF, XPOT, TXLNA GSTO1 1334/4885MAPT 34/4885MEN1 2468/4885
US-20230218774-A1 DRUG ANTIBODY CONJUGATES B3GAT3, MGAT3, SDAD1 GSTO1 103/4885MAPT 1687/4885MEN1 3959/4885

“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.