SCHEMBL7145242

SCHEMBL7145242

CCC(C=Cc1ccccc1)=C(C=C(C)C(=O)O)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
NPC1 O15118 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
AKR1C3 P42330 1/20 0.45
HAO1 Q9UJM8 1/20 0.44
ALDH1A1 P00352 3/20 0.43
HDAC3 O15379 2/20 0.43
HDAC4 P56524 2/20 0.43
HDAC1 Q13547 2/20 0.43
HDAC2 Q92769 2/20 0.43
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
PLIN1 O60240 2/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 2/20 0.43
CYP2C9 P11712 2/20 0.43
RECQL P46063 2/20 0.43
PLIN5 Q00G26 2/20 0.43
ABHD5 Q8WTS1 2/20 0.43

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
SCHEMBL8433038 0.88 GLA (0.49) GLATDP1NPC1L3MBTL1AKR1C3
SCHEMBL3430406 0.86 HDAC3 (0.45) GLATDP1NPC1L3MBTL1AKR1C3
SCHEMBL3806310 0.86 TDP1 (0.52) GLATDP1NPC1L3MBTL1HAO1
SCHEMBL6013509 0.84 EGFR (0.49) GLATDP1NPC1L3MBTL1AKR1C3
SCHEMBL6635732 0.82 HDAC3 (0.55) GLATDP1NPC1L3MBTL1HAO1
SCHEMBL2913879 0.81 SMN1; SMN2 (0.49) GLATDP1SMN1; SMN2KMT2AMAOB
SCHEMBL4879282 0.80 GLA (0.56) GLATDP1NPC1L3MBTL1HAO1
SCHEMBL905409 0.80 GLA (0.56) GLATDP1NPC1L3MBTL1HAO1
SCHEMBL8526405 0.79 HDAC3 (0.55) GLATDP1NPC1L3MBTL1HAO1
SCHEMBL10705055 0.78 HDAC3 (0.45) GLATDP1NPC1L3MBTL1AKR1C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4388372-A POLYAMIDE YARN, EPOXY RESIN-CARBOXY POLYMER-TERT-AMINE PRODUCT, PERFLUOROALKYL CITRATE URETHANE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-06-14 US claimed
US-4325857-A PERFLUOROALKYL CITRATE URETHANE, CARBOXYLIC ACID ADDITION POLYMER-EPOXY RESIN-TERT-AMINE PRODUCT E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-04-20 US claimed
US-6512025-B2 A simple continuous process to control the kinetics of a reactive polymer/crosslinker under shear at a temperature and time to delay crosslinking; adding a liquid carrier to the melt and forming spherical particles upon cooling IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 2003-01-28 US disclosed
EP-0906360-B1 DISPERSION PROCESS ICI PLC (GB) 2002-08-21 EP disclosed
US-20010012863-A1 Dispersion process IMPERIAL CHEMICAL INDUSTRIES PLC 2001-08-09 US disclosed
US-6204310-B1 MIXING TOGETHER AS A MELT A RESIN AND A CROSSLINKER UNDER EXTRUSION CONDITIONS; DISPERSING THE MIXTURE WHILE STILL MOLTEN INTO THE LIQUID CARRIER AND ALLOWING THE MOLTEN DISPERSED MIXTURE TO SOLIDIFY TO FORM PARTICLES. IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 2001-03-20 US disclosed
EP-0906360-A1 DISPERSION PROCESS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1999-04-07 EP disclosed
WO-1997045476-A1 DISPERSION PROCESS IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1997-12-04 WO disclosed
US-4388372-A POLYAMIDE YARN, EPOXY RESIN-CARBOXY POLYMER-TERT-AMINE PRODUCT, PERFLUOROALKYL CITRATE URETHANE E. I. DU PONT DE NEMOURS AND COMPANY (US) 1983-06-14 US disclosed
US-4325857-A PERFLUOROALKYL CITRATE URETHANE, CARBOXYLIC ACID ADDITION POLYMER-EPOXY RESIN-TERT-AMINE PRODUCT E. I. DU PONT DE NEMOURS AND COMPANY (US) 1982-04-20 US disclosed