SCHEMBL1743663

SCHEMBL1743663

CC(c1ccc(C(F)(F)F)cc1)C1COS(=O)(=O)N1C(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.39
NR1H3 Q13133 1/20 0.39
MAPT P10636 2/20 0.38
TACR1 P25103 6/20 0.36
MMP13 P45452 1/20 0.36
GPR119 Q8TDV5 2/20 0.36
POLB P06746 1/20 0.35
AKR1C3 P42330 1/20 0.35
AKR1C2 P52895 1/20 0.35
NOD2 Q9HC29 1/20 0.35
NOD1 Q9Y239 1/20 0.35
NPC1 O15118 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
TEAD1 P28347 2/20 0.33
P2RY14 Q15391 1/20 0.33
RORC P51449 1/20 0.33

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
SCHEMBL12241626 1.00 NR1H2 (0.39) NR1H2NR1H3MAPTTACR1MMP13
SCHEMBL9922013 1.00 NR1H2 (0.39) NR1H2NR1H3MAPTTACR1MMP13
SCHEMBL3792453 0.85 AKR1C3 (0.38) AKR1C3AKR1C2TEAD1
SCHEMBL12706284 0.84 GPR119 (0.35) NR1H2NR1H3MAPTTACR1MMP13
SCHEMBL1595353 0.84 GPR119 (0.35) NR1H2NR1H3MAPTTACR1MMP13
SCHEMBL2541261 0.83 MAPT (0.34) NR1H2NR1H3MAPTTACR1MMP13
SCHEMBL2542955 0.83 NR1H2 (0.37) NR1H2NR1H3MAPTTACR1MMP13
SCHEMBL2547952 0.83 NR1H2 (0.37) NR1H2NR1H3MAPTTACR1MMP13
SCHEMBL2549214 0.83 MAPT (0.34) NR1H2NR1H3MAPTTACR1MMP13
SCHEMBL2547625 0.78 RORC (0.31) GPR119RORC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2387570-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE Amgen, Inc (US) 2011-11-23 EP disclosed
US-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE AMGEN INC. (US) 2011-10-27 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 (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-20110263647-A1 FLUOROISOQUINOLINE SUBSTITUTED THIAZOLE COMPOUNDS AND METHODS OF USE TFEB, PCK2, JAK2 NR1H2 895/4885NR1H3 1119/4885MAPT 2794/4885

“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.