SCHEMBL6804722

SCHEMBL6804722

C=CC[C@H](C(=O)NO)[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccccc1)C(=O)O[C@H]1CCOC1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 16/20 0.65
MMP3 P08254 16/20 0.65
MMP7 P09237 15/20 0.65
MMP1 P03956 14/20 0.64
MMP8 P22894 2/20 0.64
ADAM17 P78536 2/20 0.64
MMP9 P14780 1/20 0.64
MMP12 P39900 1/20 0.64
MMP13 P45452 1/20 0.64
MMP14 P50281 1/20 0.64
CTSL P07711 1/20 0.54
FCER2 P06734 3/20 0.49

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
SCHEMBL13696746 0.89 MMP2 (0.70) MMP2MMP3MMP7MMP1MMP8
SCHEMBL7883062 0.89 MMP2 (0.70) MMP2MMP3MMP7MMP1MMP8
SCHEMBL4422495 0.89 MMP2 (0.70) MMP2MMP3MMP7MMP1MMP8
SCHEMBL7883057 0.89 MMP2 (0.70) MMP2MMP3MMP7MMP1MMP8
SCHEMBL4422794 0.88 MMP2 (0.69) MMP2MMP3MMP7MMP1MMP8
SCHEMBL4431005 0.86 MMP2 (0.66) MMP2MMP3MMP7MMP1MMP8
SCHEMBL4428170 0.83 MMP2 (0.81) MMP2MMP3MMP7MMP1MMP8
SCHEMBL7654835 0.82 MMP2 (0.59) MMP2MMP3MMP7MMP1MMP8
SCHEMBL4421723 0.81 MMP2 (0.78) MMP2MMP3MMP7MMP1MMP8
SCHEMBL4431974 0.81 MMP2 (0.78) MMP2MMP3MMP7MMP1MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6790834-B1 Cytostatic agents BRITISH BIOTECH PHARMACEUTICALS, LTD. (GB) 2004-09-14 US claimed
US-11344542-B2 Treatment of aging-associated disease with modulators of leukotriene A4 hydrolase ALKAHEST, INC. (US) 2022-05-31 US disclosed
US-20200368220-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase ALKAHEST, INC. 2020-11-26 US disclosed
US-20190350917-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase ALKAHEST, INC. 2019-11-21 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 (3 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-11344542-B2 Treatment of aging-associated disease with modulators of leukotriene A4 hydrolase LTA4H, LTB4R, LTC4S MMP2 507/4885MMP3 455/4885MMP7 814/4885
US-20190350917-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase LTA4H, LTB4R, LTC4S MMP2 507/4885MMP3 455/4885MMP7 814/4885
US-20200368220-A1 Treatment of Aging-Associated Disease with Modulators of Leukotriene A4 Hydrolase LTA4H, LTB4R, LTC4S MMP2 507/4885MMP3 455/4885MMP7 814/4885

“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.