SCHEMBL5926979

SCHEMBL5926979

O=C(O)CC(NC(=O)c1cc(Cl)ccc1N(Cc1cccc2ccccc12)S(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 5/20 0.41
▸ EEF2K O00418 1/20 0.38
▸ KEAP1 Q14145 2/20 0.38
▸ NFE2L2 Q16236 2/20 0.38
▸ CCR3 P51677 2/20 0.38
▸ CYP26A1 O43174 2/20 0.37
▸ MAPT P10636 2/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ TRPM8 Q7Z2W7 1/20 0.36
▸ SUCNR1 Q9BXA5 1/20 0.36

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
SCHEMBL5927179 0.94 CTSA (0.45) CTSAKEAP1NFE2L2CYP26A1TRPM8
SCHEMBL5926976 0.88 CA2 (0.44) CCR3
SCHEMBL5926537 0.82 CTSA (0.46) CTSACYP26A1MAPTALDH1A1SMN1; SMN2
SCHEMBL5927175 0.81 ITGB1 (0.47) —
SCHEMBL5926716 0.80 CYP26A1 (0.48) CTSAKEAP1NFE2L2CYP26A1SUCNR1
SCHEMBL5926506 0.79 CYP26A1 (0.46) CTSACYP26A1MAPTALDH1A1SMN1; SMN2
SCHEMBL5926616 0.79 MMP1 (0.49) CTSAKEAP1NFE2L2CYP26A1MAPT
SCHEMBL8337871 0.78 KEAP1 (0.45) KEAP1NFE2L2MEN1KMT2ATRPM8
SCHEMBL5926872 0.76 ADAMTS5 (0.44) CTSAKEAP1NFE2L2CYP26A1SUCNR1
SCHEMBL5927232 0.76 CYP26A1 (0.44) CTSACYP26A1

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 CTSA 426/4885EEF2K 3149/4885KEAP1 1383/4885

“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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