SCHEMBL8363734

SCHEMBL8363734

Cc1ccc(NC(=O)C2CCCCC2)cc1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.74
HPGD P15428 1/20 0.69
ENPP3 O14638 3/20 0.68
ENPP1 P22413 3/20 0.68
ENPP2 Q13822 2/20 0.68
NPSR1 Q6W5P4 2/20 0.67
LMNA P02545 1/20 0.67
KDM4E B2RXH2 1/20 0.66
MAPT P10636 1/20 0.66
RAB9A P51151 2/20 0.62
GAA P10253 1/20 0.62
KMT2A Q03164 1/20 0.62
ALDH1A1 P00352 1/20 0.61
CYP2C19 P33261 1/20 0.61
NPC1 O15118 1/20 0.61
EPHX1 P07099 1/20 0.61
NAMPT P43490 1/20 0.61

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
SCHEMBL1339196 0.98 PTPN1 (0.71) PTPN1HPGDENPP3ENPP1ENPP2
SCHEMBL7863859 0.95 PTPN1 (0.66) PTPN1HPGDENPP3ENPP1ENPP2
SCHEMBL7865123 0.91 NAMPT (0.72) PTPN1ENPP3ENPP1ENPP2NPSR1
SCHEMBL28656982 0.91 PTPN1 (0.89) PTPN1HPGDENPP3ENPP1ENPP2
SCHEMBL125695 0.91 PTPN1 (0.89) PTPN1HPGDENPP3ENPP1ENPP2
Hydrochloric Acid SCHEMBL435505 0.89 NAMPT (0.70) PTPN1ENPP3ENPP1ENPP2NPSR1
SCHEMBL13105759 0.86 PTPN1 (0.74) PTPN1HPGDENPP3ENPP1ENPP2
SCHEMBL29057710 0.84 PTPN1 (0.77) PTPN1HPGDENPP3ENPP1ENPP2
SCHEMBL9851155 0.84 PTPN1 (0.77) PTPN1HPGDENPP3ENPP1ENPP2
SCHEMBL13144615 0.83 ALDH1A1 (0.58) ENPP3ENPP1ENPP2NPSR1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024050825-A1 COMPOUNDS AS MLKL INHIBITORS NATIONAL INSTITUTE OF BIOLOGICAL SCIENCES, BEIJING (CN) 2024-03-14 WO disclosed
EP-3049387-B1 THERMOPLASTIC POLYMER COMPOSITION MILLIKEN & CO (US) 2020-11-11 EP disclosed
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 EP disclosed
US-7220532-B2 Chemical amplification type resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-22 US disclosed
US-7220532-B2 Chemical amplification type resist composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-05-22 US disclosed
WO-2003007954-A2 SULFONYL ARYL HYDROXAMATES AND THEIR USE AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-01-30 WO disclosed