SCHEMBL5860633

SCHEMBL5860633

COC(=O)c1sc(-c2ccc(C(F)(F)F)cc2)cc1CBr

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 1/20 0.51
KDM4E B2RXH2 10/20 0.48
MAPT P10636 5/20 0.48
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
CASP3 P42574 2/20 0.48
SENP8 Q96LD8 2/20 0.48
SENP7 Q9BQF6 2/20 0.48
SENP6 Q9GZR1 2/20 0.48
NPSR1 Q6W5P4 4/20 0.45
CRHBP P24387 3/20 0.45
CRHR2 Q13324 3/20 0.45
MAPK1 P28482 2/20 0.45
TP53 P04637 2/20 0.44
RXFP1 Q9HBX9 1/20 0.44
HPGD P15428 2/20 0.43
GFER P55789 1/20 0.43
MAPK8 P45983 1/20 0.42
MAPK10 P53779 1/20 0.42
ALDH1A1 P00352 2/20 0.41

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
SCHEMBL28941592 0.90 IKBKB (0.46) IKBKBKDM4EMAPTNPC1RAB9A
SCHEMBL5861849 0.88 MAPT (0.55) KDM4EMAPTNPC1RAB9ACASP3
SCHEMBL1729198 0.83 MAPT (0.59) IKBKBKDM4EMAPTNPC1RAB9A
SCHEMBL5862775 0.82 IKBKB (0.52) IKBKBKDM4EMAPTNPC1RAB9A
SCHEMBL28941594 0.81 IKBKB (0.50) IKBKBKDM4EMAPTNPC1RAB9A
SCHEMBL23452097 0.81 NPSR1 (0.56) IKBKBKDM4EMAPTNPC1RAB9A
SCHEMBL27584957 0.79 MAPT (0.53) KDM4EMAPTNPC1RAB9ACASP3
SCHEMBL24212419 0.77 L3MBTL1 (0.46) IKBKBKDM4EMAPTNPSR1CRHBP
SCHEMBL23226472 0.75 CFTR (0.52) KDM4EPTPN1
SCHEMBL7040059 0.73 BDKRB1 (0.43) PTPN1

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
US-7091237-B2 Furan and thiophene derivatives that activate human peroxisome proliferator activated receptors SMITHKLINE BEECHAM CORPORATION (US) 2006-08-15 US disclosed
EP-1392674-B1 FURAN AND THIOPHENE DERIVATIVES THAT ACTIVATE HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS SMITHKLINE BEECHAM CORP (US) 2005-08-10 EP disclosed
US-20040157890-A1 Furan and thiophene derivatives that activate human peroxisome profilerator activated receptors GLAXO GROUP LIMITED (GB) 2004-08-12 US disclosed
EP-1392674-A1 FURAN AND THIOPHENE DERIVATIVES THAT ACTIVATE HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS GLAXO GROUP LIMITED (GB) 2004-03-03 EP disclosed
WO-2002092590-A1 FURAN AND THIOPHENE DERIVATIVES THAT ACTIVATE HUMAN PEROXISOME PROLIFERATOR ACTIVATED RECEPTORS GLAXO GROUP LIMITED (GB) 2002-11-21 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-20040157890-A1 Furan and thiophene derivatives that activate human peroxisome profilerator activated receptors PPARG, PPARD, PPARA IKBKB 2870/4885KDM4E 4485/4885MAPT 3315/4885

“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.