SCHEMBL4557382

SCHEMBL4557382

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

nearest known ligand 0.35

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 1/20 0.35
AKR1C3 P42330 1/20 0.31
PARP1 P09874 1/20 0.30
PARP15 Q460N3 1/20 0.30
PARP10 Q53GL7 1/20 0.30
MAPT P10636 1/20 0.30

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
SCHEMBL18827 0.81
SCHEMBL18829 0.81
Ammonia Solution, Strong SCHEMBL4656365 0.79 AKR1C3 (0.35) CYP2C9AKR1C3
SCHEMBL15411130 0.79 GRIK2 (0.37) CYP2C9AKR1C3
Ammonia Solution, Strong SCHEMBL1913737 0.79 AKR1C3 (0.35) CYP2C9AKR1C3
Acrylic Acid SCHEMBL10461112 0.78 LMNA (0.39) CYP2C9
SCHEMBL358241 0.77 GRIK1 (0.34) CYP2C9AKR1C3
SCHEMBL17354055 0.76 LMNA (0.36)
SCHEMBL4740580 0.75 GABRR1 (0.41) CYP2C9PARP1PARP15PARP10
SCHEMBL8746228 0.75 AKR1C3 (0.33) CYP2C9AKR1C3MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7537666-B2 Method for arming composit-fabrication of open-air located objects GRP PLASTICORR (HU) 2009-05-26 US disclosed
US-20070292621-A1 Method for Arming Composit-Fabrication of Open-Air Located Objects MOL FOLDGAZSZALLITO RT. (HU) 2007-12-20 US disclosed
EP-1773922-A1 METHOD FOR ARMING COMPOSIT-FABRICATION OF OPEN-AIR LOCATED OBJECTS GRP Plasticorr (HU) 2007-04-18 EP disclosed
WO-2005121224-A1 METHOD FOR ARMING COMPOSIT-FABRICATION OF OPEN-AIR LOCATED OBJECTS GRP PLASTICORR (HU) 2005-12-22 WO disclosed
EP-0657483-A1 Water-dilutable two-component coating composition HOECHST AKTIENGESELLSCHAFT (DE) 1995-06-14 EP disclosed
EP-0614951-A2 Process for the preparation of aqueous uni-coloured coating compositions by use of module systems Herberts Gesellschaft mit beschränkter Haftung (DE) 1994-09-14 EP disclosed
EP-0522420-A2 Polyurethane dispersions HOECHST AKTIENGESELLSCHAFT (DE) 1993-01-13 EP disclosed