SCHEMBL5380528

SCHEMBL5380528

CN(C)C(=O)n1cnc(SC2CCOc3ccccc32)n1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP1 O94782 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
GAA P10253 1/20 0.33
NTRK1 P04629 1/20 0.33
BDKRB1 P46663 1/20 0.33
P2RX7 Q99572 1/20 0.32
MAPK1 P28482 6/20 0.32
P2RX4 Q99571 1/20 0.32
SSTR4 P31391 1/20 0.32
USP2 O75604 1/20 0.31
PKM P14618 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
RIPK1 Q13546 1/20 0.31
GABRA1 P14867 1/20 0.31
GABRA3 P34903 1/20 0.31
GABRB2 P47870 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
SCHEMBL5380340 0.76 DPP4 (0.41) USP1NTRK1BDKRB1P2RX4SSTR4
SCHEMBL5374063 0.73 DPP4 (0.36) SMN1; SMN2MEN1KMT2A
SCHEMBL8105747 0.70 POLB (0.41) SMN1; SMN2NTRK1PKMMEN1KMT2A
SCHEMBL5371763 0.67 MAPK1 (0.35) USP1MAPK1
SCHEMBL10381575 0.67 ITGB2 (0.38) USP1SMN1; SMN2SSTR4MEN1KMT2A
SCHEMBL11376332 0.66 ACHE (0.36) MEN1KMT2A
SCHEMBL5374190 0.66 DPP4 (0.49) MAPK1KMT2A
SCHEMBL5374193 0.66 DPP4 (0.49) MAPK1KMT2A
SCHEMBL5376960 0.65 DAGLA (0.36) GAAP2RX4
SCHEMBL5376216 0.65 NPC1 (0.52) SMN1; SMN2MAPK1PKMMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7238720-B2 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2007-07-03 US disclosed
US-7238720-B2 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2007-07-03 US disclosed
EP-1258480-B1 Pharmaceutical use of N-Carbamoylazole derivatives EISAI CO LTD (JP) 2004-11-10 EP disclosed
EP-1258480-B1 Pharmaceutical use of N-Carbamoylazole derivatives EISAI CO LTD (JP) 2004-11-10 EP disclosed
US-20040186153-A1 Pharmaceutical use of N-carbamoylazole derivatives EISAI R & D MANAGEMENT CO. LTD. (JP) 2004-09-23 US disclosed
US-20030060494-A1 Pharmaceutical use of N-carbamoylazole derivatives EISAI CO., LTD. (JP) 2003-03-27 US disclosed
EP-1258480-A1 Pharmaceutical use of N-Carbamoylazole derivatives Eisai Co., Ltd. (JP) 2002-11-20 EP 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-20040186153-A1 Pharmaceutical use of N-carbamoylazole derivatives DPP4, DPP3, DPP7 USP1 804/4885SMN1; SMN2 4811/4885GAA 215/4885
US-20030060494-A1 Pharmaceutical use of N-carbamoylazole derivatives DPP4, DPP3, DPP7 USP1 804/4885SMN1; SMN2 4811/4885GAA 215/4885

“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.