SCHEMBL206699

SCHEMBL206699

CCCCCCCCc1ccc(Nc2nc(-c3ccccn3)cs2)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.63
▸ SMN1; SMN2 Q16637 4/20 0.63
▸ NFKB1 P19838 3/20 0.63
▸ NFKB2 Q00653 3/20 0.63
▸ KMT2A Q03164 3/20 0.63
▸ RELA Q04206 3/20 0.63
▸ NPSR1 Q6W5P4 2/20 0.63
▸ MEN1 O00255 2/20 0.63
▸ PPP1CA P62136 2/20 0.63
▸ NR1I2 O75469 1/20 0.63
▸ NR4A1 P22736 1/20 0.61
▸ VCP P55072 1/20 0.61
▸ NPY5R Q15761 2/20 0.58
▸ CSNK2A1 P68400 1/20 0.57
▸ NPC1 O15118 4/20 0.54
▸ RAB9A P51151 3/20 0.54
▸ HTT P42858 2/20 0.54
▸ MBD2 Q9UBB5 2/20 0.53
▸ KCNN1 Q92952 2/20 0.53
▸ KCNN2 Q9H2S1 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
SCHEMBL206259 1.00 MAPT (0.63) MAPTSMN1; SMN2NFKB1NFKB2KMT2A
SCHEMBL206487 0.91 MAPT (0.52) MAPTSMN1; SMN2NFKB1NFKB2KMT2A
SCHEMBL206530 0.91 MAPT (0.52) MAPTSMN1; SMN2NFKB1NFKB2KMT2A
SCHEMBL6368696 0.86 SLC2A1 (0.64) MAPTSMN1; SMN2NFKB1NFKB2KMT2A
SCHEMBL205469 0.85 MAPT (0.62) MAPTSMN1; SMN2NFKB1NFKB2KMT2A
SCHEMBL206048 0.85 MAPT (0.62) MAPTSMN1; SMN2NFKB1NFKB2KMT2A
Hydrochloric Acid SCHEMBL5172910 0.85 SLC2A1 (0.62) MAPTSMN1; SMN2NFKB1NFKB2KMT2A
SCHEMBL206136 0.80 MEN1 (0.65) MAPTSMN1; SMN2KMT2AMEN1VCP
SCHEMBL205525 0.80 MEN1 (0.65) MAPTSMN1; SMN2KMT2AMEN1VCP
SCHEMBL207008 0.80 MEN1 (0.65) MAPTSMN1; SMN2KMT2AMEN1VCP

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 11 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-8088806-B2 Thiazole compounds and methods of use ACHILLION PHARMACEUTICALS, INC. (US) 2012-01-03 — — 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 MAPT 2207/4885SMN1; SMN2 3252/4885NFKB1 3007/4885
US-20070004711-A1 Thiazole compounds and methods of use PIGS, CPT1A, SLC10A1 MAPT 2207/4885SMN1; SMN2 3252/4885NFKB1 3007/4885

“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.

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