SCHEMBL5477242

SCHEMBL5477242

COC(=O)c1ccccc1CSc1nc2ccccc2[nH]1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.73
NPC1 O15118 7/20 0.73
SMN1; SMN2 Q16637 5/20 0.66
LMNA P02545 2/20 0.66
HTT P42858 1/20 0.66
PRMT5 O14744 2/20 0.65
WDR77 Q9BQA1 2/20 0.65
ALDH1A1 P00352 3/20 0.64
KMT2A Q03164 3/20 0.64
MEN1 O00255 2/20 0.64
RECQL P46063 1/20 0.64
NFKB1 P19838 2/20 0.57
NFKB2 Q00653 2/20 0.57
RELA Q04206 2/20 0.57
HPGD P15428 2/20 0.57
MAPT P10636 2/20 0.53
HDAC3 O15379 1/20 0.53
HDAC4 P56524 1/20 0.53
HDAC1 Q13547 1/20 0.53
HDAC7 Q8WUI4 1/20 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
SCHEMBL6480697 0.90 RAB9A (0.63) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL5479816 0.87 RAB9A (0.62) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL5485409 0.86 RAB9A (0.56) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL5472719 0.85 PRMT5 (0.54) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL5479157 0.82 RAB9A (0.53) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL5479149 0.82 RAB9A (0.53) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL5475685 0.81 RAB9A (0.59) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL5478987 0.81 RAB9A (0.64) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL1061025 0.81 RAB9A (0.77) RAB9ANPC1SMN1; SMN2LMNAHTT
SCHEMBL5476959 0.80 RAB9A (0.59) RAB9ANPC1SMN1; SMN2LMNAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070275995-A1 Thiobenzimidazole derivatives TEIJIN PHARMA LIMITED 2007-11-29 US disclosed
US-7268145-B2 Thiobenzimidazole derivatives TEIJIN PHARMA LIMITED (JP) 2007-09-11 US disclosed
US-20060040976-A1 Thiobenzimidazole derivatives TEIJIN LIMITED 2006-02-23 US disclosed
US-20050267148-A1 Benzimidazole derivative TEIJIN LIMITED 2005-12-01 US disclosed
EP-1097926-A1 THIOBENZIMIDAZOLE DERIVATIVES TEIJIN LIMITED (JP) 2001-05-09 EP 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 (3 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-20070275995-A1 Thiobenzimidazole derivatives CMA1, SERPINB1, TMPRSS15 RAB9A 2783/4885NPC1 525/4885SMN1; SMN2 2109/4885
US-20060040976-A1 Thiobenzimidazole derivatives CMA1, SERPINB1, TMPRSS15 RAB9A 2783/4885NPC1 525/4885SMN1; SMN2 2109/4885
US-20050267148-A1 Benzimidazole derivative CMA1, SERPINB1, TPSAB1 RAB9A 3040/4885NPC1 407/4885SMN1; SMN2 1588/4885

“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.