SCHEMBL5926870

SCHEMBL5926870

O=C(O)CC(NC(=O)c1cc(Br)ccc1NS(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 2/20 0.52
▸ KCNA5 P22460 6/20 0.48
▸ CTSA P10619 3/20 0.48
▸ PTGES2 Q9H7Z7 2/20 0.46
▸ METAP2 P50579 2/20 0.45
▸ SLC10A6 Q3KNW5 2/20 0.45
▸ SLC10A2 Q12908 1/20 0.45
▸ SLC10A1 Q14973 1/20 0.45
▸ KDM1A O60341 1/20 0.43
▸ CYP26A1 O43174 2/20 0.43

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
SCHEMBL5927393 0.91 KCNA5 (0.50) KCNA5CTSAMETAP2SLC10A6SLC10A2
SCHEMBL5927111 0.90 ACLY (0.52) ACLYKCNA5CTSAPTGES2CYP26A1
SCHEMBL5926732 0.89 KCNA5 (0.51) KCNA5CTSAMETAP2SLC10A6SLC10A2
SCHEMBL5927303 0.86 LMNA (0.53) ACLYKCNA5CTSA
SCHEMBL5926772 0.85 KCNA5 (0.45) KCNA5CTSAMETAP2SLC10A6SLC10A2
SCHEMBL4000601 0.85 KDM1A (0.52) KCNA5METAP2SLC10A6SLC10A2SLC10A1
SCHEMBL5926806 0.85 KCNA5 (0.45) KCNA5CTSAMETAP2SLC10A6SLC10A2
SCHEMBL5926865 0.85 ACLY (0.52) ACLYPTGES2METAP2SLC10A6SLC10A2
SCHEMBL5927356 0.84 SLC10A2 (0.50) KCNA5METAP2SLC10A6SLC10A2SLC10A1
SCHEMBL5926378 0.84 KCNA5 (0.47) KCNA5CTSAKDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. 2006-12-07 — — 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 (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-20060276518-A1 Aryl and heteroaryl compounds and methods to modulate coagulation TFPI, F9, F2 ACLY 3952/4885KCNA5 1021/4885CTSA 426/4885

“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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