SCHEMBL6474462

SCHEMBL6474462

Cc1cc(CNC(=O)c2cc(C(=O)NCc3ccc(OCC(=O)O)cc3)ncn2)ccc1F

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MMP13 P45452 10/20 0.79
▸ MMP10 P09238 4/20 0.64
▸ MMP8 P22894 4/20 0.64
▸ MMP9 P14780 1/20 0.64
▸ EPHX2 P34913 1/20 0.49
▸ NR1H4 Q96RI1 1/20 0.49
▸ ALDH1A1 P00352 2/20 0.42
▸ HPGD P15428 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2C9 P11712 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ AKR1B1 P15121 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ FFAR1 O14842 1/20 0.41
▸ MEN1 O00255 1/20 0.40
▸ HTT P42858 1/20 0.40

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
SCHEMBL8358823 0.88 MMP13 (1.00) MMP13MMP10MMP8MMP9POLB
SCHEMBL29838134 0.88 MMP13 (1.00) MMP13MMP10MMP8MMP9POLB
SCHEMBL8331676 0.87 MMP13 (0.72) MMP13MMP10MMP8MMP9ALDH1A1
SCHEMBL4720963 0.87 MMP13 (0.72) MMP13MMP10MMP8MMP9GAA
SCHEMBL5615671 0.87 MMP13 (0.84) MMP13MMP10MMP8MMP9EPHX2
SCHEMBL8360162 0.87 MMP13 (0.88) MMP13MMP10MMP8MMP9ALDH1A1
SCHEMBL8357428 0.85 MMP13 (0.90) MMP13MMP10MMP8MMP9ALDH1A1
SCHEMBL4716566 0.85 MMP13 (0.90) MMP13MMP10MMP8MMP9NR1H4
SCHEMBL5615610 0.85 MMP13 (0.77) MMP13MMP10MMP8MMP9EPHX2
SCHEMBL15647278 0.84 MMP13 (0.86) MMP13MMP10MMP8MMP9EPHX2

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-20050004111-A1 Degenerative joints disease; osteoarthritis AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2005-01-06 — — 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-20050004111-A1 Degenerative joints disease; osteoarthritis MMP13, ADAMTS13, DPYD MMP13 1/4885MMP10 13/4885MMP8 42/4885

“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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