SCHEMBL6705784

SCHEMBL6705784

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

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 2/20 0.48
▸ CYP2D6 P10635 1/20 0.45
▸ MAPT P10636 2/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ KCNN4 O15554 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ HIF1A Q16665 1/20 0.43
▸ HDAC3 O15379 1/20 0.42
▸ HDAC4 P56524 1/20 0.42
▸ HDAC1 Q13547 1/20 0.42
▸ HDAC7 Q8WUI4 1/20 0.42
▸ HDAC2 Q92769 1/20 0.42
▸ HDAC10 Q969S8 1/20 0.42
▸ HDAC11 Q96DB2 1/20 0.42
▸ HDAC8 Q9BY41 1/20 0.42
▸ HDAC6 Q9UBN7 1/20 0.42
▸ HDAC9 Q9UKV0 1/20 0.42
▸ HDAC5 Q9UQL6 1/20 0.42
▸ CA2 P00918 1/20 0.41
▸ CA4 P22748 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
SCHEMBL28297798 0.94 CYP1A2 (0.43) CYP1A2CYP2D6MAPTKMT2AKCNN4
SCHEMBL8588532 0.90 MAPT (0.48) CYP1A2CYP2D6MAPTKMT2AKCNN4
SCHEMBL226184 0.85 CYP1A2 (0.56) CYP1A2CYP2D6MAPTKMT2AKCNN4
SCHEMBL21269074 0.82 CYP1A2 (0.54) CYP1A2CYP2D6MAPTKMT2AKCNN4
SCHEMBL21269337 0.82 CYP1A2 (0.54) CYP1A2CYP2D6MAPTKMT2AKCNN4
SCHEMBL21269593 0.82 CYP1A2 (0.54) CYP1A2CYP2D6MAPTKMT2AKCNN4
SCHEMBL3233296 0.76 CYP1A2 (0.48) CYP1A2CYP2D6MAPTKMT2AKCNN4
Nitrous Acid SCHEMBL7049171 0.76 CYP1A2 (0.48) CYP1A2CYP2D6MAPTKMT2AKCNN4
SCHEMBL1667198 0.75 MAPT (0.48) CYP1A2CYP2D6MAPTKMT2AKCNN4
SCHEMBL3523419 0.75 KCNN4 (0.58) CYP1A2CYP2D6MAPTKMT2AKCNN4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3060574-A1 ALPHA BETA MODULATING PEPTIDES Alzhyme Pty Ltd (AU) 2016-08-31 — — EP disclosed
WO-2015058258-A1 AΒ MODULATING PEPTIDES ALZHYME PTY LTD (AU) 2015-04-30 — — WO disclosed
US-20040234739-A1 Water-soluble hotmelt adhesive HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (HENKEL KGAA) (DE) 2004-11-25 — — US disclosed
EP-1263454-A2 METHODS FOR ENHANCING THE BIOAVAILABILITY OF A DRUG Praecis Pharmaceuticals Incorporated (US) 2002-12-11 — — EP disclosed
WO-2000052048-A9 MODULATORS OF BETA-AMYLOID PEPTIDE AGGREGATION COMPRISING D-AMINO ACIDS PRAECIS PHARM INC (US) 2002-04-11 — — WO disclosed
EP-1189882-A1 BIPHENYL BUTYRIC ACID DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS Co. Ltd. (KR) 2002-03-27 — — EP disclosed
WO-2001083445-A1 BIPHENYL BUTYRIC ACID DERIVATIVE AS A MATRIX METALLOPROTEINASE INHIBITOR SAMSUNG ELECTRONICS CO., LTD. (KR) 2001-11-08 — — WO disclosed
WO-2001058470-A2 METHODS FOR ENHANCING THE BIOAVAILABILITY OF A DRUG PRAECIS PHARMACEUTICALS INCORPORATED (US) 2001-08-16 — — WO disclosed
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