SCHEMBL6434289

SCHEMBL6434289

COC(=O)C1(S(=O)(=O)N2CCC(c3ccc(Br)c(C)c3)CC2)CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
PKM P14618 1/20 0.44
CYP2C19 P33261 1/20 0.44
MMP2 P08253 12/20 0.42
MMP13 P45452 8/20 0.42
MMP9 P14780 6/20 0.41
MMP3 P08254 5/20 0.39
ADAM10 O14672 5/20 0.39
ABL1 P00519 1/20 0.38
RIN1 Q13671 1/20 0.38
THRB P10828 1/20 0.37
MMP1 P03956 1/20 0.36
MAPT P10636 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
SCHEMBL6435225 0.87 MMP3 (0.38) MMP2MMP9MMP3ADAM10MMP1
SCHEMBL6438533 0.86 MMP3 (0.38) MMP2MMP9MMP3ADAM10MMP1
SCHEMBL6437561 0.86 MMP3 (0.38) MMP2MMP9MMP3ADAM10MMP1
SCHEMBL6437442 0.83 MMP3 (0.35) MMP2MMP9MMP3ADAM10ABL1
SCHEMBL6436433 0.83 MMP3 (0.35) MMP2MMP9MMP3ADAM10ABL1
SCHEMBL6433129 0.83 MMP2 (0.46) CYP3A4CYP2C9PKMCYP2C19MMP2
SCHEMBL6435679 0.82 CYP3A4 (0.46) CYP3A4CYP2C9CYP2C19MMP2MMP13
SCHEMBL6586377 0.82 MMP2 (0.51) CYP3A4CYP2C9PKMCYP2C19MMP2
SCHEMBL6439864 0.81 CYP3A4 (0.45) CYP3A4CYP2C9PKMCYP2C19MMP2
SCHEMBL6439486 0.80 MMP2 (0.52) CYP3A4CYP2C9PKMCYP2C19MMP2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050026836-A1 Composition for the treatment of damaged tissue DACK KEVIN NEIL (GB) 2005-02-03 US disclosed
US-20030199440-A1 Composition for the treatment of damaged tissue PFIZER INC. 2003-10-23 US disclosed
EP-1181017-B1 METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-04-16 EP disclosed
US-6511993-B1 Substituted alpha-aminosulphonyl-acetohydroxamic acids which are inhibitors of zinc-dependent metalloprotease enzymes PFIZER INC. 2003-01-28 US disclosed
EP-1242120-A2 COMBINATIONS OF GROWTH FACTORS AND I:UPA OR I:MMP FOR THE TREATMENT OF DAMAGED TISSUE Pfizer Limited (GB) 2002-09-25 EP disclosed
EP-1181017-A1 METALLOPROTEASE INHIBITORS Pfizer Limited (GB) 2002-02-27 EP disclosed
WO-2001049309-A2 COMBINATIONS OF GROWTH FACTORS AND I: UPA OR I: MMP FOR THE TREATMENT OF DAMAGED TISSUE PFIZER LIMITED (GB) 2001-07-12 WO disclosed
WO-2000074681-A1 METALLOPROTEASE INHIBITORS PFIZER LIMITED (GB) 2000-12-14 WO 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 (2 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-20030199440-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 CYP3A4 4668/4885CYP2C9 4559/4885PKM 3257/4885
US-20050026836-A1 Composition for the treatment of damaged tissue MMP1, SERPINE1, COL14A1 CYP3A4 4668/4885CYP2C9 4559/4885PKM 3257/4885

“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.