SCHEMBL1703764

SCHEMBL1703764

CCCNS(=O)(=O)C1CCCCC1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
MMP1 P03956 1/20 0.40
MMP7 P09237 1/20 0.40
MMP12 P39900 1/20 0.40
ECE1 P42892 1/20 0.40
MMP13 P45452 1/20 0.40
EPHX1 P07099 1/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
PPARA Q07869 2/20 0.36
BRD4 O60885 2/20 0.35
NPY5R Q15761 1/20 0.34
HTR1A P08908 1/20 0.34
PSEN1 P49768 1/20 0.34
PSEN2 P49810 1/20 0.34
APH1B Q8WW43 1/20 0.34
NCSTN Q92542 1/20 0.34
APH1A Q96BI3 1/20 0.34
PSENEN Q9NZ42 1/20 0.34
TBXAS1 P24557 1/20 0.34

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
SCHEMBL1704325 0.98 CA1 (0.46) CA1MMP1MMP7MMP12ECE1
SCHEMBL668941 0.89 CA1 (0.50) CA1PPARABRD4PSEN1PSEN2
SCHEMBL23181217 0.88 CA1 (0.48) CA1MMP1MMP7MMP12ECE1
SCHEMBL13301181 0.83 MMP1 (0.38) CA1MMP1MMP7MMP12ECE1
SCHEMBL8934429 0.80 MMP1 (0.36) CA1MMP1MMP7MMP12ECE1
SCHEMBL12102205 0.80 GABRA1 (0.47) CA1EPHX1PPARANPY5RPSEN1
SCHEMBL1705415 0.79 NPY5R (0.34) CA1MMP1MMP7MMP12ECE1
SCHEMBL10064188 0.79 NPY5R (0.34) CA1MMP1MMP7MMP12ECE1
SCHEMBL29764410 0.79 CA1 (0.40) CA1KDM4EALDH1A1PPARABRD4
Hydrochloric Acid SCHEMBL27202561 0.78 LOXL2 (0.35) CA1NPY5RHTR1ATBXAS1TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119968127-A Animal food compositions with improved palatability and customizable properties and methods of making the same 玛氏公司 2025-05-09 CN disclosed
EP-2440527-A1 PYRIDINYL DERIVATIVES AS INHIBITORS OF ENZYME NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE Topo Target A/S (DK) 2012-04-18 EP disclosed
WO-2010142735-A1 PYRIDINYL DERIVATIVES AS INHIBITORS OF ENZYME NICOTINAMIDE PHOSPHORIBOSYLTRANSFERASE TOPOTARGET A/S (DK) 2010-12-16 WO disclosed