SCHEMBL2996036

SCHEMBL2996036

Cc1ccccc1OC(=O)CCC(=O)O

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
TSHR P16473 2/20 0.51
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
PPARG P37231 1/20 0.45
LMNA P02545 1/20 0.45
RXRA P19793 1/20 0.44
RXRB P28702 1/20 0.44
RXRG P48443 1/20 0.44
NOTUM Q6P988 1/20 0.44
SMN1; SMN2 Q16637 3/20 0.44

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
SCHEMBL644115 0.93 TDP1 (0.58) ATMTDP1L3MBTL1TSHRKDM4E
SCHEMBL29941922 0.93 TDP1 (0.58) ATMTDP1L3MBTL1TSHRKDM4E
SCHEMBL28372094 0.90 KDM4E (0.53) ATMTDP1L3MBTL1TSHRKDM4E
SCHEMBL16887727 0.90 KDM4E (0.53) ATMTDP1L3MBTL1TSHRKDM4E
SCHEMBL28366840 0.88 KDM4E (0.51) ATMTDP1L3MBTL1TSHRKDM4E
SCHEMBL11593115 0.88 KDM4E (0.51) ATMTDP1L3MBTL1TSHRKDM4E
SCHEMBL28370999 0.88 KDM4E (0.51) ATMTDP1L3MBTL1TSHRKDM4E
SCHEMBL9468274 0.85 TDP1 (0.55) ATMTDP1L3MBTL1KDM4EMEN1
SCHEMBL3079343 0.84 TDP1 (0.54) ATMTDP1L3MBTL1KDM4EMEN1
SCHEMBL14359740 0.84 TDP1 (0.54) ATMTDP1L3MBTL1KDM4EMEN1

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
WO-2023274246-A1 AMIDE COMPOUND AND USE THEREOF 成都分迪药业有限公司 2023-01-05 WO disclosed
CN-110914334-A Polyester copolymer 阿凡田知识中心有限公司 2020-03-24 CN disclosed
US-7780801-B2 for soldering flip chip surfaces; fluxing agent comprises keto acid such as levulinic acid or acetylbutyric acid; mixture of tacky solvent (ethoxylated glycerol) with non-tacky solvent (methanol) INTERNATIONAL BUSINESS MACHINES CORPORATION (US) 2010-08-24 US disclosed
US-20080124568-A1 New flux composition and process for use thereof GLOBALFOUNDRIES INC. (KY) 2008-05-29 US disclosed