SCHEMBL5926872

SCHEMBL5926872

O=C(O)CC(NC(=O)c1cc(Cl)ccc1N(CCCc1ccccc1)S(=O)(=O)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ADAMTS5 Q9UNA0 2/20 0.44
▸ CTSA P10619 3/20 0.43
▸ CYP26A1 O43174 2/20 0.43
▸ UTS2R Q9UKP6 8/20 0.41
▸ KEAP1 Q14145 1/20 0.40
▸ NFE2L2 Q16236 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ SUCNR1 Q9BXA5 2/20 0.39

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
SCHEMBL5926537 0.88 CTSA (0.46) CTSACYP26A1
SCHEMBL5926716 0.87 CYP26A1 (0.48) CTSACYP26A1UTS2RKEAP1NFE2L2
SCHEMBL5926864 0.86 ADAMTS5 (0.52) ADAMTS5
SCHEMBL5926506 0.85 CYP26A1 (0.46) CTSACYP26A1
SCHEMBL5926616 0.84 MMP1 (0.49) CTSACYP26A1KEAP1NFE2L2THRB
SCHEMBL5927342 0.83 UTS2R (0.46) CTSACYP26A1UTS2RTHRBSUCNR1
SCHEMBL5926685 0.81 CTSA (0.44) CTSACYP26A1UTS2RTHRBSUCNR1
SCHEMBL5927179 0.81 CTSA (0.45) CTSACYP26A1KEAP1NFE2L2SUCNR1
SCHEMBL5927232 0.80 CYP26A1 (0.44) CTSACYP26A1UTS2R
SCHEMBL5927468 0.79 CTSA (0.45) CTSACYP26A1UTS2RSUCNR1

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 ADAMTS5 65/4885CTSA 426/4885CYP26A1 526/4885

“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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