SCHEMBL27619969

SCHEMBL27619969

CC(=O)C(=O)C(O)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.64
LMNA P02545 4/20 0.60
MAPK1 P28482 1/20 0.60
CES2 O00748 3/20 0.54
CES1 P23141 3/20 0.54
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
SRC P12931 2/20 0.44
CYP2D6 P10635 1/20 0.44
ALOX5 P09917 1/20 0.42
NAAA Q02083 2/20 0.42
KMT2A Q03164 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41

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
SCHEMBL58881 0.81 LMNA (0.65) HPGDLMNAMAPK1CES2CES1
SCHEMBL9221845 0.81 LMNA (0.65) HPGDLMNAMAPK1CES2CES1
SCHEMBL26259 0.81 LMNA (0.65) HPGDLMNAMAPK1CES2CES1
SCHEMBL890219 0.81 LMNA (0.65) HPGDLMNAMAPK1CES2CES1
SCHEMBL31223166 0.79 L3MBTL1 (0.52) HPGDLMNAMAPK1CES2CES1
Water SCHEMBL27778930 0.79 LMNA (0.62) HPGDLMNAMAPK1CES2CES1
Mandelic Acid SCHEMBL2689157 0.79 LMNA (0.86) HPGDLMNAMAPK1CES2CES1
SCHEMBL4647083 0.78 BRD4 (0.52) HPGDLMNACES2CES1CYP2D6
SCHEMBL4641885 0.78 HDAC3 (0.42) HPGDLMNACES2CES1ALDH1A1
SCHEMBL18419227 0.78 HPGD (1.00) HPGDLMNAMAPK1CES2CES1

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
CN-111511359-A Non-steroidal selective glucocorticoid receptor agonist modulators (SEGRAM) and uses thereof IGBMC研究协会(ARI) 2020-08-07 CN disclosed
CN-100519671-C Film-forming polymer and antifouling paint JOTUN AS (NO) 2009-07-29 CN disclosed
CN-1643085-A Film-forming polymer and antifouling paint JOTUN AS (NO) 2005-07-20 CN disclosed