SCHEMBL5926663

SCHEMBL5926663

O=C(O)CC(NC(=O)c1cc(Cl)ccc1NC(c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CTSA P10619 5/20 0.53
▸ CYP26A1 O43174 3/20 0.50
▸ MEN1 O00255 1/20 0.47
▸ KMT2A Q03164 1/20 0.47
▸ SUCNR1 Q9BXA5 2/20 0.47
▸ CASP3 P42574 1/20 0.45
▸ SERPINE1 P05121 1/20 0.45
▸ UTS2R Q9UKP6 6/20 0.44
▸ MMP3 P08254 1/20 0.43
▸ MMP9 P14780 1/20 0.43
▸ MMP8 P22894 1/20 0.43
▸ MMP12 P39900 1/20 0.43
▸ MMP13 P45452 1/20 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
SCHEMBL5926495 0.88 CTSA (0.50) CTSACYP26A1SUCNR1SERPINE1UTS2R
SCHEMBL5927213 0.84 CTSA (0.52) CTSACYP26A1CASP3SERPINE1
SCHEMBL5926657 0.84 ERAP1 (0.48) MEN1KMT2A
SCHEMBL5926688 0.83 CTSA (0.58) CTSACYP26A1SUCNR1UTS2RMMP3
SCHEMBL5927087 0.81 CYP26A1 (0.49) CTSACYP26A1UTS2R
SCHEMBL5926999 0.80 CTSA (0.61) CTSACYP26A1
SCHEMBL5926904 0.80 CTSA (0.50) CTSACYP26A1MEN1KMT2ASUCNR1
SCHEMBL5927203 0.79 CHRM1 (0.48) CTSACYP26A1
SCHEMBL5927580 0.77 CTSA (0.43) CTSACYP26A1SUCNR1CASP3
SCHEMBL5926649 0.77 ACLY (0.53) CTSA

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 426/4885CYP26A1 526/4885MEN1 3448/4885

“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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