SCHEMBL28477753

SCHEMBL28477753

CCCC(CC)(CC)c1cccc(C(=O)O)c1C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 3/20 0.36
ALDH1A1 P00352 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HPGD P15428 1/20 0.35
HSD17B10 Q99714 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
LMNA P02545 1/20 0.35
CLCN2 P51788 1/20 0.35
TSHR P16473 1/20 0.35
POLB P06746 1/20 0.35
TAS2R14 Q9NYV8 1/20 0.35
KMT2A Q03164 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
BID P55957 3/20 0.34
MCL1 Q07820 3/20 0.34
BCL2L1 Q07817 2/20 0.34
BAK1 Q16611 2/20 0.34
KAT8 Q9H7Z6 2/20 0.34
MEN1 O00255 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
SCHEMBL21947 0.90 BID (0.40) ALDH1A1KDM4ETSHRKMT2ABID
SCHEMBL183937 0.85 BID (0.43) ALOX15ALDH1A1KDM4EHSD17B10BID
SCHEMBL3822399 0.85 ALDH1A1 (0.35) ALOX15ALDH1A1KDM4ETDP1LMNA
SCHEMBL165623 0.82 BID (0.44) ALOX15ALDH1A1KDM4EHSD17B10BID
SCHEMBL7764644 0.82 BID (0.44) ALOX15ALDH1A1KDM4EHSD17B10BID
SCHEMBL26622690 0.82 BID (0.44) ALOX15ALDH1A1KDM4EHSD17B10BID
SCHEMBL11224449 0.82 BID (0.41) ALDH1A1KDM4ETSHRKMT2ABID
SCHEMBL6152073 0.82 BID (0.44) ALOX15ALDH1A1KDM4EHSD17B10BID
SCHEMBL6229449 0.81 BID (0.43) ALOX15ALDH1A1KDM4EHSD17B10BID
SCHEMBL7457422 0.81 BID (0.43) ALOX15ALDH1A1KDM4EHSD17B10BID

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111848845-B Catalyst for preparing low-entanglement ultrahigh molecular weight polyethylene and preparation method thereof 江苏扬农化工集团有限公司 2023-03-24 CN disclosed
CN-111848845-A Catalyst for preparing low-entanglement ultrahigh molecular weight polyethylene and preparation method thereof 江苏扬农化工集团有限公司 2020-10-30 CN disclosed