SCHEMBL11544154

SCHEMBL11544154

O=C1C=C(c2cccc3ccccc23)C(=O)O1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 1/20 0.56
KDM4E B2RXH2 3/20 0.47
ALPL P05186 1/20 0.47
GAA P10253 1/20 0.47
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
POLB P06746 1/20 0.42
TYMS P04818 1/20 0.41
ALDH1A1 P00352 3/20 0.39
MAPT P10636 3/20 0.39
HPGD P15428 3/20 0.39
MAPK1 P28482 2/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
TDP2 O95551 1/20 0.39
ALOX12 P18054 1/20 0.39
CASP3 P42574 1/20 0.39
HTT P42858 1/20 0.39
GALK1 P51570 1/20 0.39
BLM P54132 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39

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
SCHEMBL15323008 0.78 PTPN1 (0.43) PTPN1KDM4EALPLGAAMAOA
SCHEMBL29128768 0.73 PTPN1 (0.51) PTPN1KDM4EALPLGAAPOLB
SCHEMBL10879753 0.72 MAPK1 (0.41) PTPN1GAAMAOAMAOBALDH1A1
SCHEMBL28179294 0.72 PTPN1 (0.53) PTPN1MAOAMAOBALDH1A1MAPT
SCHEMBL27678183 0.72 PTPN1 (0.47) PTPN1MAOAMAOBALDH1A1HPGD
SCHEMBL1471929 0.72 ALOX15 (0.41) PTPN1POLBMAPTHPGDNPSR1
SCHEMBL2687976 0.72 CYP1A2 (0.42) KDM4EGAAMAOAMAOBPOLB
SCHEMBL10407696 0.72 PTPRC (0.53) PTPN1GAAMAOBTYMSALDH1A1
SCHEMBL197980 0.72 PTPN1 (0.59) PTPN1KDM4EALPLGAAMAOA
SCHEMBL6235934 0.72 PTPN1 (1.00) PTPN1KDM4EALPLGAAALDH1A1

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
US-4143007-A THICKENING AGENT CONTAINING A POLYGALACTOMANNAN GUM AND A COPOLYMER OF AN OLEFINICALLY UNSATURATED DICARBOXYLIC ACID ANHYDRIDE USEFUL IN HYDRAULIC WELL-TREATING CELANESE CORPORATION (US) 1979-03-06 US disclosed
US-4075167-A MALEIMIDO GROUP-CONTAINING ORGANOSILICON COMPOUNDS DAI NIPPON PRINTING CO., LTD. (JA) 1978-02-21 US disclosed
US-4019904-A INK REPELLENT DAI NIPPON PRINTING COMPANY LIMITED (JA) 1977-04-26 US disclosed