SCHEMBL6863042

SCHEMBL6863042

CCC(C)c1cccc(OCO)c1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.50
HDAC2 Q92769 1/20 0.50
HDAC8 Q9BY41 1/20 0.50
TSHR P16473 2/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 3/20 0.41
USP2 O75604 1/20 0.41
GAA P10253 1/20 0.41
PKM P14618 1/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
HSD17B10 Q99714 1/20 0.41
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALOX5 P09917 1/20 0.39
FAAH O00519 1/20 0.38
BCHE P06276 1/20 0.38
ACHE P22303 1/20 0.38
PTGS1 P23219 1/20 0.38

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
SCHEMBL19121486 0.83 HDAC4 (0.46) HDAC4HDAC2HDAC8TSHRKDM4E
SCHEMBL11954263 0.83 KDM4E (0.53) HDAC4HDAC2HDAC8TSHRKDM4E
SCHEMBL19445358 0.81 HDAC4 (0.45) HDAC4HDAC2HDAC8TSHRKDM4E
SCHEMBL825481 0.81 HDAC4 (0.45) HDAC4HDAC2HDAC8TSHRKDM4E
SCHEMBL14119424 0.81 TSHR (0.51) HDAC4HDAC2HDAC8TSHRKDM4E
SCHEMBL2632814 0.80 CASR (0.51) HDAC4HDAC2HDAC8KDM4EALDH1A1
SCHEMBL14162717 0.80 CASR (0.51) HDAC4HDAC2HDAC8KDM4EALDH1A1
SCHEMBL10192231 0.80 CASR (0.51) HDAC4HDAC2HDAC8KDM4EALDH1A1
SCHEMBL11992976 0.80 CASR (0.51) HDAC4HDAC2HDAC8KDM4EALDH1A1
SCHEMBL11999043 0.80 HDAC4 (0.44) HDAC4HDAC2HDAC8TSHRKDM4E

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6709724-B1 Metal catalyzed ascorbate compounds as oxygen scavengers W. R. GRACE & CO.-CONN. 2004-03-23 US disclosed
US-6656383-B1 First polymeric carrier, catalyzing agent dispersed throughout the second concentrate, second polymeric carrier; liners or gasketing materials for crowns, closures, lids or caps of bottles or cans; packaging W. R. GRACE & CO.-CONN. 2003-12-02 US disclosed
EP-1077683-B1 ANTIDEPRESSANT THERAPY ALZA CORP (US) 2002-12-11 EP disclosed
US-6465065-B1 CONTAINERS HAVING WATER PERMEABLE POLYMER LININGS CONTAINING OXIDATION CATALYSTS AND SODIUM ASCORBATE FOR USE IN PACKAGING BEVERAGES, FOODS AND DRUGS W.R. GRACE & CO.-CONN. 2002-10-15 US disclosed
US-6391406-B1 PACKAGING OXYGEN SENSITIVE MATERIALS SUCH AS FOODSTUFFS, BEVERAGES, AND PHARAMCEUTICALS; ASCORBIC ACID OR A SALT THEREOF DISPERSED RELATIVELY UNIFORMLY THROUGHOUT A POLYMERIC CARRIER W. R. GRACE & CO.-CONN. 2002-05-21 US disclosed
US-20010055614-A1 Antidepressant therapy SEROFF SYLVIA (US) 2001-12-27 US disclosed
EP-1077683-A1 ANTIDEPRESSANT THERAPY ALZA CORPORATION (US) 2001-02-28 EP disclosed
EP-0527207-B1 POLYMER COMPOSITIONS CONTAINING OXYGEN SCAVENGING COMPOUNDS GRACE W R & CO (US) 2000-10-25 EP disclosed
EP-0664824-B1 POLYMER COMPOSITIONS CONTAINING OXYGEN SCAVENGING COMPOUNDS ADVANCED OXYGEN TECHNOLOGIES I (US) 2000-01-19 EP disclosed
WO-1999058115-A1 ANTIDEPRESSANT THERAPY ALZA CORPORATION (US) 1999-11-18 WO disclosed
WO-1994009084-A1 POLYMER COMPOSITIONS CONTAINING OXYGEN SCAVENGING COMPOUNDS ADVANCED OXYGEN TECHNOLOGIES, INC. (US) 1994-04-28 WO disclosed
US-5246711-A Dosage form for treating dysthymia ALZA CORPORATION (US) 1993-09-21 US disclosed
US-5246710-A Dosage form for treating cyclothymia ALZA CORPORATION (US) 1993-09-21 US disclosed
US-5202052-A Blends with polymeric carriers for beverage container closures or food packaging AQUANAUTICS CORPORATION (US) 1993-04-13 US disclosed
EP-0527207-A1 POLYMER COMPOSITIONS CONTAINING OXYGEN SCAVENGING COMPOUNDS ZAPATA INDUSTRIES, INC. (US) 1993-02-17 EP disclosed
US-5185158-A Dosage form comprising succinimide drug for treating depressive disorders and composition comprising same ALZA CORPORATION (US) 1993-02-09 US disclosed
WO-1991017044-A1 POLYMER COMPOSITIONS CONTAINING OXYGEN SCAVENGING COMPOUNDS ZAPATA INDUSTRIES, INC. (US) 1991-11-14 WO disclosed
EP-0008131-B1 POLY(ETHYLENE OXIDE) COMPOSITIONS UNION CARBIDE CORPORATION (US) 1982-12-22 EP disclosed
US-4211681-A Poly(ethylene oxide) compositions UNION CARBIDE CORPORATION (US) 1980-07-08 US disclosed
EP-0008131-A1 Poly(ethylene oxide) compositions UNION CARBIDE CORPORATION (US) 1980-02-20 EP disclosed