SCHEMBL207532

SCHEMBL207532

CCCCCOc1ccc(Nc2nc(-c3cc(-c4ccc(Cl)c(Cl)c4)no3)cs2)cc1F

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 0.46
VCP P55072 1/20 0.46
CFTR P13569 1/20 0.44
PTGES O14684 3/20 0.41
ABL1 P00519 5/20 0.38
CYP1A1 P04798 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP1B1 Q16678 1/20 0.38
PPARG P37231 1/20 0.37
PPARA Q07869 1/20 0.37
SPHK1 Q9NYA1 5/20 0.37
SPHK2 Q9NRA0 4/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
EGFR P00533 1/20 0.36
ERBB2 P04626 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
SCHEMBL204189 0.89 ALOX5 (0.43) ALOX5VCPCFTRPTGESABL1
SCHEMBL251736 0.86 ALOX5 (0.47) ALOX5VCPCFTRPTGESABL1
SCHEMBL206151 0.81 ALOX5 (0.53) ALOX5VCPCFTRPTGESABL1
SCHEMBL206015 0.79 PTGS2 (0.51) ALOX5VCPPTGESCYP1A1CYP1A2
SCHEMBL207054 0.79 MAPT (0.54) ALOX5VCPPTGESCYP1A1CYP1A2
SCHEMBL10190593 0.79 CFTR (0.45) CFTRPTGESALDH1A1MAPTEGFR
SCHEMBL205708 0.79 CFTR (0.59) CFTRALDH1A1MAPT
SCHEMBL205267 0.78 CYP1A1 (0.53) ALOX5VCPCFTRPTGESCYP1A1
SCHEMBL205496 0.78 PTGES (0.46) ALOX5CFTRPTGESCYP1A1CYP1A2
SCHEMBL205485 0.78 ALOX5 (0.61) ALOX5VCPCFTRPTGESABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108576-A1 THIAZOLE COMPOUNDS AND METHODS OF USE ACHILLION PHARMACEUTICALS, INC. (US) 2012-05-03 US claimed
US-20120108576-A1 THIAZOLE COMPOUNDS AND METHODS OF USE ACHILLION PHARMACEUTICALS, INC. (US) 2012-05-03 US disclosed
US-20120108576-A1 THIAZOLE COMPOUNDS AND METHODS OF USE ACHILLION PHARMACEUTICALS, INC. (US) 2012-05-03 US disclosed
US-20120108576-A1 THIAZOLE COMPOUNDS AND METHODS OF USE ACHILLION PHARMACEUTICALS, INC. (US) 2012-05-03 US disclosed
US-8088806-B2 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. (US) 2012-01-03 US disclosed
US-8088806-B2 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. (US) 2012-01-03 US disclosed
US-8088806-B2 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. (US) 2012-01-03 US disclosed
US-20070004711-A1 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. 2007-01-04 US disclosed
US-20070004711-A1 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. 2007-01-04 US disclosed
US-20070004711-A1 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. 2007-01-04 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 (2 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-20120108576-A1 THIAZOLE COMPOUNDS AND METHODS OF USE PIGS, CPT1A, SLC10A1 ALOX5 3410/4885VCP 1270/4885CFTR 111/4885
US-20070004711-A1 Thiazole compounds and methods of use PIGS, CPT1A, SLC10A1 ALOX5 3410/4885VCP 1270/4885CFTR 111/4885

“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.