SCHEMBL6498950

SCHEMBL6498950

CCOc1cc(-c2ccccc2)ccc1C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADRB3 P13945 4/20 0.60
ADRB1 P08588 3/20 0.60
MKNK1 Q9BUB5 1/20 0.56
MKNK2 Q9HBH9 1/20 0.56
MCL1 Q07820 2/20 0.54
RXRA P19793 1/20 0.54
RXRB P28702 1/20 0.54
HNF4A P41235 2/20 0.53
ACMSD Q8TDX5 2/20 0.53
DCLRE1A Q6PJP8 1/20 0.51
DCLRE1B Q9H816 1/20 0.51
LMNA P02545 2/20 0.51
FDPS P14324 1/20 0.49
NEK2 P51955 1/20 0.49
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
KDM4E B2RXH2 1/20 0.49
ALDH1A1 P00352 1/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL2769244 0.93 ADRB1 (0.55) ADRB3ADRB1MKNK1MKNK2MCL1
SCHEMBL12121775 0.88 PTPN11 (0.60) ADRB3ADRB1MCL1HNF4AACMSD
SCHEMBL6496898 0.88 KDM4E (0.53) ADRB3ADRB1MKNK1MKNK2RXRA
SCHEMBL6505249 0.88 ADRB1 (0.52) ADRB3ADRB1MKNK1MKNK2MCL1
SCHEMBL4603368 0.87 PTPN11 (0.59) ADRB3ADRB1MCL1RXRARXRB
SCHEMBL6501061 0.86 TSHR (0.53) ADRB3ADRB1MKNK1MKNK2LMNA
SCHEMBL4600417 0.84 PTPN11 (0.60) ADRB3ADRB1MCL1RXRARXRB
SCHEMBL1316077 0.83 MCL1 (0.71) MCL1HNF4AACMSDDCLRE1ADCLRE1B
SCHEMBL4815310 0.82 RARB (0.58) ADRB3ADRB1MCL1LMNANPC1
SCHEMBL504872 0.81 CHEK1 (0.60) ADRB3ADRB1MKNK1MKNK2MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118108762-A Active ester resin with phosphorus and self-extinguishing characteristic structure, and preparation method and application thereof 四川东材科技集团股份有限公司 2024-05-31 CN claimed
CN-118108762-A Active ester resin with phosphorus and self-extinguishing characteristic structure, and preparation method and application thereof 四川东材科技集团股份有限公司 2024-05-31 CN disclosed
US-6884821-B1 Carboxylic acid derivatives and drugs containing the same EISAI CO., LTD. (JP) 2005-04-26 US disclosed
EP-1216980-A1 CARBOXYLIC ACID DERIVATIVES AND DRUGS CONTAINING THE SAME Eisai Co., Ltd. (JP) 2002-06-26 EP disclosed