SCHEMBL5405060

SCHEMBL5405060

Cn1cc(Cn2c(SCCCC(=O)O)nc3ccccc32)c2ccccc21

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CMA1 P23946 3/20 0.60
CTSG P08311 2/20 0.60
L3MBTL1 Q9Y468 1/20 0.58
PTGDR2 Q9Y5Y4 7/20 0.54
KMT2A Q03164 2/20 0.53
SLC12A2 P55011 1/20 0.53
SLC12A5 Q9H2X9 1/20 0.53
HCRTR1 O43613 1/20 0.51
MAPK1 P28482 1/20 0.51
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PDPK1 O15530 1/20 0.49
AR P10275 1/20 0.49

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
SCHEMBL5404422 0.92 KMT2A (0.55) CMA1CTSGL3MBTL1PTGDR2KMT2A
SCHEMBL5622412 0.91 CTSG (0.57) CMA1CTSGL3MBTL1PTGDR2KMT2A
SCHEMBL5620546 0.89 CMA1 (0.54) CMA1CTSGL3MBTL1PTGDR2KMT2A
SCHEMBL14577952 0.88 PTGDR2 (0.67) CMA1CTSGL3MBTL1PTGDR2SMN1; SMN2
SCHEMBL5622802 0.86 CTSG (0.71) CMA1CTSGL3MBTL1PTGDR2KMT2A
SCHEMBL5621097 0.85 CTSG (0.60) CMA1CTSGL3MBTL1PTGDR2KMT2A
SCHEMBL5621193 0.85 CTSG (0.60) CMA1CTSGL3MBTL1PTGDR2HCRTR1
SCHEMBL4307028 0.84 SLC12A2 (0.67) CMA1CTSGL3MBTL1PTGDR2KMT2A
SCHEMBL7027475 0.83 SLC12A2 (0.66) CMA1CTSGL3MBTL1PTGDR2KMT2A
SCHEMBL7027470 0.83 SLC12A2 (0.66) CMA1CTSGL3MBTL1PTGDR2KMT2A

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-7176320-B2 Benzimidazole derivative TEIJIN LIMITED (JP) 2007-02-13 US disclosed
US-7176320-B2 Benzimidazole derivative TEIJIN LIMITED (JP) 2007-02-13 US disclosed
US-7176320-B2 Benzimidazole derivative TEIJIN LIMITED (JP) 2007-02-13 US disclosed
US-20040162311-A1 Benzimidazole derivative TEIJIN LIMITED 2004-08-19 US disclosed
EP-1249450-A1 BENZIMIDAZOLE DERIVATIVES TEIJIN LIMITED (JP) 2002-10-16 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 (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-20040162311-A1 Benzimidazole derivative CMA1, CBR3, CBR1 CMA1 1/4885CTSG 486/4885L3MBTL1 2686/4885

“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.