SCHEMBL207889

SCHEMBL207889

CCOC(=O)Cc1ccc(-c2csc(Nc3ccc(OCCCc4ccco4)c(C(F)(F)F)c3)n2)s1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.37
SMN1; SMN2 Q16637 6/20 0.37
HTT P42858 3/20 0.37
NPC1 O15118 3/20 0.37
RAB9A P51151 3/20 0.37
GAA P10253 5/20 0.37
KDM4E B2RXH2 4/20 0.37
HPGD P15428 2/20 0.37
SYK P43405 2/20 0.37
LMNA P02545 2/20 0.36
MAPK1 P28482 2/20 0.36
DHODH Q02127 2/20 0.36
MEN1 O00255 6/20 0.36
KMT2A Q03164 6/20 0.36
CFTR P13569 1/20 0.36
ALDH1A1 P00352 5/20 0.35
TP53 P04637 2/20 0.35
NTRK1 P04629 1/20 0.34
USP2 O75604 1/20 0.34
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL206316 0.90 NTRK1 (0.39) MAPTSMN1; SMN2NPC1RAB9AGAA
SCHEMBL207932 0.88 DHODH (0.40) MAPTSMN1; SMN2GAAKDM4EHPGD
SCHEMBL205834 0.87 MEN1 (0.39) MAPTSMN1; SMN2NPC1GAAKDM4E
SCHEMBL207791 0.87 HDAC8 (0.44) MAPTSMN1; SMN2HTTGAAKDM4E
SCHEMBL207828 0.85 ALDH1A1 (0.45) MAPTSMN1; SMN2GAAKDM4EHPGD
SCHEMBL2695588 0.85 NTRK1 (0.36) MAPTSMN1; SMN2HTTNPC1RAB9A
SCHEMBL2755841 0.83 MAPT (0.35) MAPTSMN1; SMN2HTTNPC1RAB9A
SCHEMBL2705660 0.83 DHODH (0.39) MAPTSMN1; SMN2HTTNPC1RAB9A
SCHEMBL206856 0.80 S1PR1 (0.49) MAPTGAAKDM4ELMNAMEN1
SCHEMBL208337 0.80 S1PR1 (0.51) MAPTGAALMNAMEN1KMT2A

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 7 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-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

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 MAPT 2207/4885SMN1; SMN2 3252/4885HTT 809/4885
US-20070004711-A1 Thiazole compounds and methods of use PIGS, CPT1A, SLC10A1 MAPT 2207/4885SMN1; SMN2 3252/4885HTT 809/4885

“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.