SCHEMBL5165367

SCHEMBL5165367

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.48
CYP2D6 P10635 2/20 0.48
MAPT P10636 2/20 0.44
KMT2A Q03164 1/20 0.44
HIF1A Q16665 2/20 0.42
CYP2C19 P33261 1/20 0.42
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
KIF11 P52732 3/20 0.41
CYP2C9 P11712 2/20 0.40
LMNA P02545 2/20 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
SCHEMBL14615318 0.85 CYP2D6 (0.42) CYP1A2CYP2D6MAPTHIF1AKIF11
SCHEMBL60359 0.83 CYP1A2 (0.52) CYP1A2CYP2D6MAPTKMT2AHIF1A
SCHEMBL3304253 0.83 CYP1A2 (0.57) CYP1A2CYP2D6MAPTKMT2AHIF1A
SCHEMBL27943003 0.83 KCNN4 (0.47) CYP1A2CYP2D6KMT2ACYP2C19HDAC3
SCHEMBL28727642 0.82 CYP1A2 (0.55) CYP1A2CYP2D6MAPTKMT2AHIF1A
SCHEMBL28727574 0.82 CYP1A2 (0.55) CYP1A2CYP2D6MAPTKMT2AHIF1A
SCHEMBL10445349 0.80 CYP2D6 (0.48) CYP1A2CYP2D6MAPTKMT2AHIF1A
SCHEMBL17065513 0.80 CYP1A2 (0.48) CYP1A2CYP2D6MAPTKMT2AHIF1A
SCHEMBL1666946 0.80 CYP1A2 (0.53) CYP1A2CYP2D6MAPTKMT2AHIF1A
SCHEMBL4365780 0.79 CYP1A2 (0.47) CYP1A2CYP2D6MAPTKMT2AHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108358831-B Polysubstituted carbazole derivative and preparation method thereof 山东师范大学 2020-09-29 CN disclosed
EP-1618157-B1 USE OF POLYANHYDRIDES IN ANTIFOULING PAINT AND ANTIFOULING PAINT CONTAINING POLYANHYDRIDES JOTUN AS (NO) 2007-03-14 EP disclosed
EP-1618157-A1 POLYANHYDRIDES, PROCESS FOR THE PREPARATION, USE IN ANTIFOULING PAINT AND ANTIFOULING PAINT CONTAINING POLYANHYDRIDES Jotun AS (NO) 2006-01-25 EP disclosed
WO-2004096927-A1 POLYANHYDRIDES, PROCESS FOR THE PREPARATION, USE IN ANTIFOULING PAINT AND ANTIFOULING PAINT CONTAINING POLYANHYDRIDES JOTUN AS (NO) 2004-11-11 WO disclosed
US-4620027-A OXIDATIVE CARBONYLATION OF STYRENE COMPOUNDS SUN REFINING AND MARKETING COMPANY (US) 1986-10-28 US disclosed
US-4536592-A ANTISECRETORY AGENT G. D. SEARLE & CO. (US) 1985-08-20 US disclosed