SCHEMBL4987461

SCHEMBL4987461

CC(=O)Nc1nc(CCc2ccc(NC(N(C(=O)O)C(C)(C)C)N(C(=O)O)C(C)(C)C)cc2)c(C(=O)N2CCC[C@@H]2C(=O)N(C)C)s1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
UCHL1 P09936 1/20 0.37
USP30 Q70CQ3 1/20 0.37
CCR1 P32246 11/20 0.35
AOC3 Q16853 5/20 0.34
ACACB O00763 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TACR1 P25103 1/20 0.31

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
SCHEMBL4988770 1.00 UCHL1 (0.37) UCHL1USP30CCR1AOC3ACACB
SCHEMBL4988481 0.88 AOC3 (0.34) AOC3
SCHEMBL4874902 0.87 UCHL1 (0.36) UCHL1USP30CCR1AOC3
SCHEMBL4871816 0.87 UCHL1 (0.36) UCHL1USP30CCR1AOC3
SCHEMBL4987383 0.86 AOC3 (0.37) UCHL1USP30CCR1AOC3
SCHEMBL4988773 0.84 UCHL1 (0.36) UCHL1USP30CCR1AOC3L3MBTL1
SCHEMBL4987468 0.84 UCHL1 (0.36) UCHL1USP30CCR1AOC3L3MBTL1
SCHEMBL4864901 0.83 AOC3 (0.36) AOC3
SCHEMBL14019579 0.83 SPHK1 (0.39) UCHL1USP30CCR1AOC3
SCHEMBL14019576 0.83 SPHK1 (0.39) UCHL1USP30CCR1AOC3

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-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2008-05-22 US disclosed
US-20060229346-A1 Method for treating vascular hyperpermeable disease SUCAMPO AG (CH) 2006-10-12 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 (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-20080119462-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE VCAM1, ICAM1, VAPB UCHL1 2631/4885USP30 2782/4885CCR1 1961/4885
US-20060229346-A1 Method for treating vascular hyperpermeable disease VCAM1, VAPB, ICAM1 UCHL1 3580/4885USP30 4341/4885CCR1 2076/4885

“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.