SCHEMBL208515

SCHEMBL208515

CCCCCCCCOc1ccc(Nc2nc(-c3ccc(Cl)cc3)cs2)cc1C(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 13/20 0.58
VCP P55072 3/20 0.53
PTGS2 P35354 3/20 0.48
MEN1 O00255 2/20 0.47
MAPT P10636 2/20 0.47
KMT2A Q03164 2/20 0.47
DEGS1 O15121 1/20 0.47
MAP4K4 O95819 1/20 0.47
CYP3A4 P08684 1/20 0.47
AMY1A P0DUB6 1/20 0.47
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
MAPK1 P28482 1/20 0.47
MAPKAPK2 P49137 1/20 0.47
PIM3 Q86V86 1/20 0.47
MINK1 Q8N4C8 1/20 0.47
SPHK2 Q9NRA0 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SPHK1 Q9NYA1 1/20 0.47
ESR1 P03372 1/20 0.46

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
SCHEMBL2700258 0.99 ALOX5 (0.59) ALOX5VCPPTGS2MEN1MAPT
SCHEMBL206430 0.92 ALOX5 (0.47) ALOX5VCPPTGS2MEN1MAPT
SCHEMBL206916 0.91 ALOX5 (0.48) ALOX5VCPPTGS2MEN1MAPT
SCHEMBL207991 0.90 ALOX5 (0.45) ALOX5VCPPTGS2MEN1KMT2A
SCHEMBL206595 0.90 MAPT (0.46) ALOX5VCPPTGS2MEN1MAPT
SCHEMBL204744 0.90 MAPT (0.48) ALOX5VCPMEN1MAPTKMT2A
SCHEMBL204577 0.89 ALOX5 (0.46) ALOX5VCPPTGS2MEN1MAPT
SCHEMBL205026 0.89 PTGS2 (0.56) ALOX5VCPPTGS2MEN1MAPT
SCHEMBL206060 0.89 PTGES (0.46) ALOX5VCPMEN1KMT2A
SCHEMBL206446 0.88 ALOX5 (0.43) ALOX5VCPPTGS2MEN1MAPT

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 1270/4885PTGS2 3352/4885
US-20070004711-A1 Thiazole compounds and methods of use PIGS, CPT1A, SLC10A1 ALOX5 3410/4885VCP 1270/4885PTGS2 3352/4885

“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.