SCHEMBL2928169

SCHEMBL2928169

O=Cc1ccc(S(=O)(=O)C(F)(F)F)c(OCc2ccccc2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.48
MAOB P27338 3/20 0.48
ALDH1A1 P00352 5/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
NPC1 O15118 2/20 0.42
MAPT P10636 2/20 0.42
RAB9A P51151 2/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
TACR2 P21452 1/20 0.41
KDM4E B2RXH2 3/20 0.40
PDCD1 Q15116 1/20 0.40
CD274 Q9NZQ7 1/20 0.40
HPGD P15428 1/20 0.40
PTPRZ1 P23471 1/20 0.40
GSK3B P49841 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP19A1 P11511 1/20 0.39
CCNB2 O95067 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
SCHEMBL13176911 0.82 MAOA (0.48) MAOAMAOBALDH1A1SMN1; SMN2NPC1
SCHEMBL6542864 0.81 ALDH1A1 (0.54) ALDH1A1MAPTL3MBTL1TACR2KDM4E
SCHEMBL3954569 0.77 RXRA (0.52) MAOAMAOBALDH1A1SMN1; SMN2NPC1
SCHEMBL29446267 0.77 TACR2 (0.62) MAOAMAOBALDH1A1SMN1; SMN2NPC1
SCHEMBL584489 0.77 TACR2 (0.62) MAOAMAOBALDH1A1SMN1; SMN2NPC1
SCHEMBL2461447 0.76 MAOA (0.56) MAOAMAOBALDH1A1SMN1; SMN2NPC1
SCHEMBL6542213 0.76 ALDH1A1 (0.54) ALDH1A1SMN1; SMN2MAPTHPGDLMNA
Trifluoromethanesulfonic Acid SCHEMBL1110880 0.76 MAOA (0.42) MAOAMAOBALDH1A1SMN1; SMN2NPC1
SCHEMBL3956772 0.76 MAOA (0.52) MAOAMAOBALDH1A1SMN1; SMN2NPC1
SCHEMBL5217355 0.75 TACR2 (0.54) MAOAMAOBALDH1A1SMN1; SMN2TACR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1313731-B1 THIAZOLIDINE DERIVATIVES AND ITS USE AS ANTIFUNGAL AGENT UCB SA (BE) 2010-09-29 EP disclosed
US-6740670-B2 SUCH AS 5-(((3-(N-METHYL-N-PHENYLAMINO)CARBONYL-4-(PHENYL-METHOXY)) -PHENYL)METHYLENE)-4-OXO-2-THIOXO-3-THIAZOLIDINE-ACETIC ACID OXFORD GLYCOSCIENCES (UK) LTD. (GB) 2004-05-25 US disclosed
US-20030216453-A1 Thiazolidine derivatives and its use as antifungal agent OXFORD GLYCOSCIENCES (UK) LTD (GB) 2003-11-20 US disclosed
EP-1313731-A1 THIAZOLIDINE DERIVATIVES AND ITS USE AS ANTIFUNGAL AGENT Oxford GlycoSciences (UK) Limited (GB) 2003-05-28 EP disclosed
WO-2002022612-A1 THIAZOLIDINE DERIVATIVES AND ITS USE AS ANTIFUNGAL AGENT OXFORD GLYCOSCIENCES (UK) LIMITED (GB) 2002-03-21 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 (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-20030216453-A1 Thiazolidine derivatives and its use as antifungal agent CYP3A7, TAS2R7, OXSR1 MAOA 3397/4885MAOB 2540/4885ALDH1A1 2527/4885

“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.