SCHEMBL5622802

SCHEMBL5622802

Cc1cccc2c1c(Cn1c(SCCCC(=O)O)nc3ccccc31)cn2C

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSG P08311 3/20 0.71
CMA1 P23946 3/20 0.71
L3MBTL1 Q9Y468 2/20 0.54
PDPK1 O15530 3/20 0.53
KMT2A Q03164 1/20 0.53
PTGDR2 Q9Y5Y4 7/20 0.52
ATM Q13315 1/20 0.50
HCRTR1 O43613 1/20 0.49
TP53 P04637 1/20 0.49
AR P10275 1/20 0.48

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
SCHEMBL5622038 0.91 CMA1 (0.59) CTSGCMA1L3MBTL1PDPK1KMT2A
SCHEMBL5621097 0.90 CTSG (0.60) CTSGCMA1L3MBTL1PDPK1KMT2A
SCHEMBL5621193 0.90 CTSG (0.60) CTSGCMA1L3MBTL1PTGDR2HCRTR1
SCHEMBL5266755 0.89 PTGDR2 (0.64) CTSGCMA1L3MBTL1PDPK1KMT2A
SCHEMBL5620685 0.88 CMA1 (0.57) CTSGCMA1L3MBTL1PDPK1KMT2A
SCHEMBL5622172 0.88 CMA1 (0.57) CTSGCMA1L3MBTL1PDPK1KMT2A
SCHEMBL4455217 0.87 CTSG (0.75) CTSGCMA1L3MBTL1PDPK1KMT2A
SCHEMBL14577955 0.87 CMA1 (0.54) CTSGCMA1L3MBTL1PDPK1KMT2A
SCHEMBL5405060 0.86 CMA1 (0.60) CTSGCMA1L3MBTL1PDPK1KMT2A
SCHEMBL5622412 0.83 CTSG (0.57) CTSGCMA1L3MBTL1PDPK1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070032466-A1 Drug containing chymase inhibitor as the active ingredient TEIJIN PHARMA LIMITED (JP) 2007-02-08 US claimed
EP-1666067-A1 DRUG CONTAINING CHYMASE INHIBITOR AS THE ACTIVE INGREDIENT Teijin Pharma Limited (JP) 2006-06-07 EP claimed
EP-1249450-B1 BENZIMIDAZOLE DERIVATIVES AS HUMAN CHYMASE INHIBITORS TEIJIN PHARMA LTD (JP) 2007-10-10 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-20070032466-A1 Drug containing chymase inhibitor as the active ingredient REN, SERPINB1, CMA1 CTSG 40/4885CMA1 3/4885L3MBTL1 4241/4885

“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.