SCHEMBL15411130

SCHEMBL15411130

C=CCC=C(C)C(=O)O.[PbH2]

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GRIK2 Q13002 1/20 0.37
AKR1C3 P42330 1/20 0.35
ALDH1A1 P00352 1/20 0.33
CD81 P60033 1/20 0.32
CYP2C9 P11712 1/20 0.32
PTGS1 P23219 1/20 0.31
PPARG P37231 1/20 0.31

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 0.98
SCHEMBL18829 0.98
Ammonia Solution, Strong SCHEMBL4656365 0.95 AKR1C3 (0.35) GRIK2AKR1C3ALDH1A1CD81CYP2C9
Ammonia Solution, Strong SCHEMBL1913737 0.95 AKR1C3 (0.35) GRIK2AKR1C3ALDH1A1CD81CYP2C9
Methacrylic Acid SCHEMBL9548918 0.91 AKR1C3 (0.33) GRIK2AKR1C3ALDH1A1CD81CYP2C9
Methacrylic Acid SCHEMBL5870711 0.91 AKR1C3 (0.33) GRIK2AKR1C3ALDH1A1CD81CYP2C9
Dimethylamine SCHEMBL11437111 0.91 AKR1C3 (0.33) GRIK2AKR1C3ALDH1A1CD81CYP2C9
Acrylic Acid SCHEMBL4042912 0.91 LMNA (0.43) GRIK2AKR1C3ALDH1A1CD81CYP2C9
SCHEMBL9639042 0.91 AKR1C3 (0.33) GRIK2AKR1C3ALDH1A1CD81CYP2C9
SCHEMBL8746228 0.91 AKR1C3 (0.33) GRIK2AKR1C3ALDH1A1CD81CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9434903-B2 Friction-improved polymers for DLC-coated surfaces EVONIK OIL ADDITIVES GMBH (DE) 2016-09-06 US disclosed
US-20140005084-A1 FRICTION-IMPROVED POLYMERS FOR DLC-COATED SURFACES EVONIK OIL ADDITIVES GMBH (DE) 2014-01-02 US disclosed