SCHEMBL2433452

SCHEMBL2433452

CC(C)(C)OC(=O)N1CCC[C@@H](NCCC(=O)OCc2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
USP30 Q70CQ3 3/20 0.54
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
HTT P42858 1/20 0.45
GABRA5 P31644 1/20 0.45
HTR6 P50406 4/20 0.44
BCHE P06276 2/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
JAK2 O60674 1/20 0.44
JAK1 P23458 1/20 0.44
GPR119 Q8TDV5 1/20 0.44
STS P08842 1/20 0.44
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
ACKR3 P25106 1/20 0.44
PARP1 P09874 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
SCHEMBL2433449 1.00 USP30 (0.54) USP30MEN1KMT2AHTTGABRA5
SCHEMBL20986825 0.88 USP30 (0.54) USP30MEN1KMT2AHTTGABRA5
SCHEMBL20986823 0.88 USP30 (0.54) USP30MEN1KMT2AHTTGABRA5
SCHEMBL7016338 0.88 L3MBTL1 (0.53) MEN1KMT2AHTTL3MBTL1GPR119
SCHEMBL10226748 0.86 USP30 (0.60) USP30GABRA5HTR6BCHEJAK2
SCHEMBL16163467 0.86 USP30 (0.60) USP30GABRA5HTR6BCHEJAK2
SCHEMBL2728420 0.86 USP30 (0.60) USP30GABRA5HTR6BCHEJAK2
SCHEMBL7304645 0.85 ITGB3 (0.60) USP30MEN1KMT2AHTTSTS
SCHEMBL3710438 0.84 USP30 (0.50) USP30MEN1KMT2AHTTITGB3
SCHEMBL3313424 0.84 USP30 (0.63) USP30KMT2AGABRA5L3MBTL1JAK2

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
EP-2366698-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor Galapagos SAS (FR) 2011-09-21 EP disclosed
US-20080125424-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor GALAPAGOS SAS (FR) 2008-05-29 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-20080125424-A1 Derivatives of urea and related diamines, methods for their manufacture, and uses therefor UTS2R, CASR, GPR17 USP30 1960/4885MEN1 2770/4885KMT2A 4672/4885

“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.