SCHEMBL5266012

SCHEMBL5266012

CCOC(=O)CCCSc1nc2ccccc2[nH]1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.69
LMNA P02545 6/20 0.69
MAPT P10636 7/20 0.65
ALDH1A1 P00352 2/20 0.65
KDM4E B2RXH2 2/20 0.65
NSD2 O96028 1/20 0.65
ABL1 P00519 1/20 0.65
RIN1 Q13671 1/20 0.65
L3MBTL1 Q9Y468 1/20 0.65
NPC1 O15118 1/20 0.64
RAB9A P51151 1/20 0.64
GAA P10253 1/20 0.64
HTT P42858 1/20 0.62
SMN1; SMN2 Q16637 3/20 0.62
KMT2A Q03164 2/20 0.61
MEN1 O00255 1/20 0.61
MAPK1 P28482 1/20 0.60
POLB P06746 1/20 0.60

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
SCHEMBL9431194 0.96 MAPT (0.67) NPSR1LMNAMAPTALDH1A1KDM4E
SCHEMBL7864977 0.95 MAPT (0.66) NPSR1LMNAMAPTALDH1A1KDM4E
SCHEMBL7857190 0.95 MAPT (0.66) NPSR1LMNAMAPTALDH1A1KDM4E
SCHEMBL7867868 0.95 MAPT (0.66) NPSR1LMNAMAPTALDH1A1KDM4E
SCHEMBL3542412 0.88 LMNA (0.72) NPSR1LMNAMAPTALDH1A1KDM4E
SCHEMBL10760288 0.86 LMNA (0.66) NPSR1LMNAMAPTALDH1A1KDM4E
SCHEMBL944312 0.85 POLB (0.72) MAPTALDH1A1KDM4ENSD2ABL1
SCHEMBL20545268 0.83 LMNA (0.65) NPSR1LMNAMAPTKDM4ENPC1
SCHEMBL5267033 0.83 HRH4 (0.54) NPSR1LMNAMAPTALDH1A1KDM4E
SCHEMBL10760234 0.83 MAPT (0.60) NPSR1LMNAMAPTALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1249450-B1 BENZIMIDAZOLE DERIVATIVES AS HUMAN CHYMASE INHIBITORS TEIJIN PHARMA LTD (JP) 2007-10-10 EP 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-7176320-B2 Benzimidazole derivative TEIJIN LIMITED (JP) 2007-02-13 US disclosed
US-20050267148-A1 Benzimidazole derivative TEIJIN LIMITED 2005-12-01 US disclosed
US-20040162311-A1 Benzimidazole derivative TEIJIN LIMITED 2004-08-19 US disclosed
US-20040010004-A1 Benzimidazole derivatives TEIJIN LIMITED (JP) 2004-01-15 US disclosed
US-20030083315-A1 Human chymase inhibitors TEIJIN LIMITED (JP) 2003-05-01 US disclosed
EP-1249450-A1 BENZIMIDAZOLE DERIVATIVES TEIJIN LIMITED (JP) 2002-10-16 EP disclosed
EP-1167360-A9 HUMAN CHYMASE INHIBITORS TEIJIN LIMITED (JP) 2002-05-15 EP disclosed
EP-1167360-A1 HUMAN CHYMASE INHIBITORS TEIJIN LIMITED (JP) 2002-01-02 EP disclosed
US-5128359-A Benzimidazole and azabenzimidazole derivatives which are thromboxane receptor antagonists, their methods of preparation LABORATOIRES UPSA (FR) 1992-07-07 US disclosed
US-5124336-A Cardiovascular disorders LABORATOIRES UPSA (FR) 1992-06-23 US disclosed
US-5021443-A Noval benzimidazole and azabenzimiazole derivatives which are thromboxane receptor antagonists, their methods of preparation and pharmaceutical compositions in which they are present LABORATOIRES UPSA (FR) 1991-06-04 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 (4 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 NPSR1 1118/4885LMNA 1813/4885MAPT 4120/4885
US-20030083315-A1 Human chymase inhibitors CMA1, CTRL, CPA4 NPSR1 974/4885LMNA 2529/4885MAPT 3505/4885
US-20040010004-A1 Benzimidazole derivatives CMA1, CBR3, CBR1 NPSR1 1099/4885LMNA 1790/4885MAPT 4101/4885
US-20050267148-A1 Benzimidazole derivative CMA1, SERPINB1, TPSAB1 NPSR1 4118/4885LMNA 3900/4885MAPT 4269/4885

“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.