SCHEMBL5927232

SCHEMBL5927232

Cc1ccsc1CN(c1ccc(Cl)cc1C(=O)NC(CC(=O)O)c1ccc(-c2ccccc2)cc1)S(=O)(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP26A1 O43174 7/20 0.44
▸ CTSA P10619 5/20 0.40
▸ MMP9 P14780 2/20 0.39
▸ MMP13 P45452 2/20 0.39
▸ MMP3 P08254 1/20 0.39
▸ MMP8 P22894 1/20 0.39
▸ MMP12 P39900 1/20 0.39
▸ MMP1 P03956 1/20 0.38
▸ UTS2R Q9UKP6 6/20 0.38

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
SCHEMBL5927227 0.87 ITGB1 (0.44) MMP9MMP13MMP1
SCHEMBL5926537 0.86 CTSA (0.46) CYP26A1CTSAMMP9MMP13MMP3
SCHEMBL5926616 0.85 MMP1 (0.49) CYP26A1CTSAMMP9MMP13MMP1
SCHEMBL5926716 0.85 CYP26A1 (0.48) CYP26A1CTSAUTS2R
SCHEMBL5926506 0.85 CYP26A1 (0.46) CYP26A1CTSAMMP9MMP13MMP1
SCHEMBL5927179 0.81 CTSA (0.45) CYP26A1CTSAMMP3
SCHEMBL5926872 0.80 ADAMTS5 (0.44) CYP26A1CTSAUTS2R
SCHEMBL5927468 0.77 CTSA (0.45) CYP26A1CTSAUTS2R
SCHEMBL5926979 0.76 CTSA (0.41) CYP26A1CTSA
SCHEMBL5926568 0.75 CTSA (0.42) CYP26A1CTSAMMP9MMP13MMP3

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 2 patents. 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
US-7122580-B2 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. (US) 2006-10-17 — — 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 CYP26A1 526/4885CTSA 426/4885MMP9 149/4885

“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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