SCHEMBL251408

SCHEMBL251408

CCCCCCCCOc1ccc(Nc2nc(-c3ccc(O)c(O)c3)cs2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.60
HSPE1 P61604 1/20 0.60
ALOX5 P09917 1/20 0.60
MEN1 O00255 11/20 0.53
KMT2A Q03164 11/20 0.53
GAA P10253 10/20 0.53
MAPT P10636 8/20 0.53
POLB P06746 7/20 0.53
KDM4E B2RXH2 5/20 0.53
ALDH1A1 P00352 5/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
HTT P42858 3/20 0.53
ALOX12 P18054 3/20 0.53
MAPK1 P28482 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
PKM P14618 2/20 0.53
LMNA P02545 2/20 0.53
ALOX15 P16050 2/20 0.53
TSHR P16473 2/20 0.53
HSD17B10 Q99714 2/20 0.53

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
SCHEMBL251233 1.00 HSPD1 (0.60) HSPD1HSPE1ALOX5MEN1KMT2A
SCHEMBL250505 0.88 ALOX5 (0.54) HSPD1HSPE1ALOX5MEN1KMT2A
SCHEMBL2697859 0.88 ALOX5 (0.54) HSPD1HSPE1ALOX5MEN1KMT2A
SCHEMBL249562 0.88 ALOX5 (0.77) ALOX5MEN1KMT2AGAAMAPT
SCHEMBL250114 0.87 VCP (0.65) ALOX5MEN1KMT2AGAAMAPT
SCHEMBL250576 0.87 VCP (0.65) ALOX5MEN1KMT2AGAAMAPT
SCHEMBL206705 0.85 ALOX5 (0.54) ALOX5MEN1KMT2AGAAMAPT
SCHEMBL207323 0.85 ALOX5 (0.60) ALOX5MEN1KMT2AGAAMAPT
SCHEMBL251157 0.85 ALOX5 (0.60) ALOX5MEN1KMT2AGAAMAPT
SCHEMBL208609 0.85 HSPD1 (0.63) HSPD1HSPE1ALOX5MEN1KMT2A

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 HSPD1 3658/4885HSPE1 2914/4885ALOX5 3410/4885
US-20070004711-A1 Thiazole compounds and methods of use PIGS, CPT1A, SLC10A1 HSPD1 3658/4885HSPE1 2914/4885ALOX5 3410/4885

“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.